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List of reviews, popular articles and original
papers
Reviews in Polish
Reviews in English
Popular articles and books
Orginal papers
Reviews
(in Polish)
- Krygowski T. M., Grzegorczyk M.,: "Teoretyczne
uzasadnienie" metody Rozdział w monografii Krygowski B.,
Graniformametria mechaniczna, Teoria i zastosowanie, PTPN, Poznań 1964
str. 28-40
- Krygowski T. M., Wiad.Chem. 28, 37, 1974. Równanie
Hammetta-Steitwiesera.
- Krygowski T. M., Rozprawy Uniwersytetu Warszawskiego.
(1974) Przejawy zmian strukturalnych we wlaściwościach
fizykochemicznych cząsteczek związków π-elektronowych.
- Krygowski T. M., Kruszewski J., Wiad. Chem. 29, 113, 1975.
Definicje i kryteria indeksów aromatyczności.
- Krygowski T. M., Lipsztajn M., Wiad. Chem. 31, 729, 1977.
Rola środowiska reakcji w elektroredukcji nitrozwiązków aromatycznych.
- Krygowski T. M., Kruszewski J., Ilościowe kryteria
aromatyczności. Monografia Prace Nauk. Inst.Chemii Org. i Fiz.
Politechniki Wrocławskiej, Wrocław (1978).
- Krygowski T. M., Czermiński J. B., Wiad. Chem., 32, 547,
1978. Chemiczne modele efektu rozpuszczalnikowego.
- Czermiński J. B., Krygowski T. M., Wiad. Chem. 32, 259,
1978. Fizyczne modele efektu rozpuszczalnikowego.
- Krygowski T. M., Wrona T.K., Statystyczne opracowanie
danych doswiadczalnych str. 38 w Elektroanalityczne metody wyznaczania
stalych fizykochemicznych pod red. Z.Galus, PWN Warszawa 1979.
- Krygowski T. M., Lasia A., Wyznaczanie stałych równowagi
reakcji chemicznych metodami elektrochemicznymi str. 129 j.w.
- Krygowski T. M., Wiad. Chem. 35, 315, 1981. O relacjach
między strukturą a reaktywnością.
- Krygowski T. M., Wiad. Chem. 41, 7, 1987. Analiza
korelacyjna w krystalochemii organicznej.
- Krygowski T. M., Wiad. Chem. 43, 861, 1989. Co
krystalografia może dać chemikowi.
- Krygowski T. M., Woźniak K.,Wiad. Chemiczne, 46, 4353,
1992. Strukturalne skutki wiązania wodorowego.
- Cyrański, M. K., Krygowski, T.M., Wiad. Chemiczne, 54,
533, 2000, Ilościowe kryteria aromatyczności.
- Cyrański, M. K., Krygowski, T.M., Wiad. Chemiczne, 54,
533, 2000, Aromatyczność - podstawowe pojęcie współczesnej chemii
organicznej.
Reviews
(in English)
- Kemula W., Krygowski T. M., Chapt. XIII-2, Nitroso
compounds, in Encyclopedia of Electrochemistry of the Elements Vol.13
p. 78-130, A.J.Bard and H.Lund Edts. M.Dekker (1979)
- Kemula W., Krygowski T. M., Chapt.XIII-3, Nitroso
compounds, in Encyclopedia of Electrochemistry of the Elements Vol.13,
p. 131-161, A.J.Bard and H.Lund Edts. M.Dekker (1979)
- Kalinowski M. K., Krygowski T. M. Croat. Chim Acta 58, 107
(1985) Application of the LFER in Organic Electrochemistry:
Interpretation of the Hammett Reaction Constant (rho) for Processes of
Reversible Electroreduction in Aprotic Solvents.
- Krygowski T.M., Structure and Reactivity Edt. J. L.
Liebman and A. Greenberg, (VerlagChemie, 1988) 231-254. Resonance
structure contributions derived from the experimental geometry of
molecules.
- Krygowski T. M., Progr. in Phys. Org. Chem. Vol. 17, Edt.
R.W. Taft (1990) 239-291, Correlation analysis in organic crystal
chemistry.
- Krygowski T. M. & Wozniak K. in Similarity models in
organic chemistry, biochemistry and related fields. Edts. R. I.
Zalewski, T. M. Krygowski & J. Shorter, Elsevier (1991). Similarity
models: statistical tools and problems in using them.
- Krygowski, T. M. Organic crystal chemistry. Edited by J.
B. Garbarczyk and D. W. Jones, Oxford Univ. Press (1991), 55-73.
Crystallographic studies of inter and intramolecular interactions.
- Krygowski T. M., Wozniak, K. in The Chemistry of Amidines
and Imidates. Edt. by S. Patai and Z. Rappaprt, (1991), Vol.2, 102-145.
Structural chemistry of amidines and related systems.
- Woźniak K., Krygowski T. M., in Correlations,
transformations, and interactions in organic crystal chemistry. Edt. by
D.W.Jones and A. Katrusiak Oxford Univ. Press (1994), 177-202.
Long-range consequences of hydrogen bonding: a partial correlation
approach to relationships among structural parameters.
- Exner O., Krygowski T. M., Chem. Soc. Rev. (1996), 71. The
Nitro Group as Substituent.
- Krygowski T.M. and Cyranski M.K., in Advances in Molecular
Structure Research, JAI Pres Inc. 1997, M. Hargittai and I. Hargittai
Edts, vol. 3,: "Aromatic Character of carbocyclic π-electron systems
deduced from molecular geometry". pp.227- 268.
- Krygowski T. M. and Cyranski M.K., in Theoretical and
Computational Chemistry Elsevier Science, 1998, C. Parkanyi Ed., Vol. 5
" Molecular Geometry as a Source of Chemical Information for π-Electron
Compounds" pp. 153 - 187.
- Krygowski, T.M., Cyrański, M.K., Czarnocki, Z.,
Haefelinger, G., Katritzky, A.R., Tetrahedron, 56, 1783, 2000.
Aromaticity: a theoretical concept of immense practical importance.
- Krygowski, T.M., Cyrański, M.K., Chem. Rev. 101, 1 (2001)
Structural aspects of aromaticity.
- Grabowski, S. J., Krygowski, T.M., in: Advances in
Quantitative Structure - Property Relationships; Marvin Charton and
Barbara Charton, Edts, JAI - Elsevier 2002; vol. 3, pp. 27 - 66.
"Molecular Geometry as a Source of Chemical Information - Application
of the Bond Valence - Bond Number Models"
2003
- 17. Krygowski, T. M., Cyrański, M. K., Angular Group
Induced Bond Alternation (AGIBA). A New Face of Substituent Effetc
Detected in Molecular Geometry. Synlett, 7, 922 - 36, 2003.
Popular articles and books
- Krygowski T. M., Chemia w szkole, (1993),1, (196) XXXIX, 5
- 11, Ewolucja poglądów na aromatyczność.
- Krygowski T.M., Chemia w szkole, (1994), (202) XL, 67-77.
Czy można zobaczyć wiązanie chemiczne?
- Krygowski, T.M., Oficyna Edukacyjna Krzysztof Pazdro,
Warszawa, 1994. 1-91,Chemia wokół nas,
Original papers
- Krygowski B., Krygowski T. M., J. Sed. Petrology, 35, 496,
1965. Mechanical Method of Estimation of the Abrasion Grade of sand
Grains.
- Kemula W., Krygowski T. M., Bull. Acad. Polon. Sci. Chim.,
15, 479, 1967. The Effective Inductive Parameter Model of the
Substituent Influences in Huckel Molecular Orbital Theory.
Mono-substituted Antharaquinones.
- Kemula W., Krygowski T. M., Tetrahedron Letters, 5135,
1968, Substituent Effects in Poorly Aromatic Systems; Dichloro
-anthraquinones and Related Semiquinone Radicals.
- Kruszewski J., Krygowski T. M., Tetrahedron Letters, 319,
1970, A Quantum Chemical Approach to the Definition of Aromaticity.
- Krygowski T. M., Tetrahedron Letters, 1311, 1970,
Aromaticity and Classification of pi-Electron Systems.
- Krygowski T. M., Tomasik P., Bull. Acad. Polon. Sci., Ser.
Sci. Chim., 18, 303, 1970. HMO-EIP Interpretation of Substituent
Effects in Polarography of some Aromatic Nitro- and Azo-Compounds.
- Kemula W., Kalinowski M. K., Krygowski T. M., Lewandowski
J., Walasek W., Bull. Acad. Polon. Sci., Ser. Sci. Chim., 18, 455,
1970. Investigation of N-Nitroderivatives. Equlibria of Nitrourea and
Nitroguanidine in Aqueous Solutions.
- Krygowski T. M., Bull. Acad. Polon. Sci., Ser. Sci. Chim.,
18, 463, 1970. HMO-Interpretation of the Hammett-Substituent Constants
in Para Position. A new method of Verification of Parameters for
HMO-Heteroatom Integrals.
- Kuthan J., Krygowski T. M., Tetrahedron. Letters, 4109,
1970. HMO-Perturbational Considerations of Correlations between
Chemical Shifts and some Theoretical Indices of Reactivity.
- Krygowski T. M., Bull. Acad. Polon. Sci., Ser. Sci. Chim.,
19, 49, 1971. Extension of the Hammett-Equation on the Polynuclear
Benzenoid Hydrocarbons: the Hammett-Streitwieser Equation.
- Krygowski T. M., Bull. Acad.Polon. Sci., Ser.Chim., 19,
61, 1971. Extension of the Hammett Equation on the Monosubstituted
Polynuclear Benzenoid Hydrocarbons- Extended Hammett-Streitwieser
Equation.
- Kamieński B., Krygowski T. M., Tetrahedron Letters, 103,
1971. HMO-EIP Treatment of the NMR Proton Chemical Shifts of
Monosubstituted Thiophenes.
- Krygowski T. M., Bull. Acad. Sci., Ser. Sci. Chim., 19,
433, 1971. Hammett-Streitwieser Equation: The Principle of Additivity.
- Krygowski T. M., Bull. Acad. Sci., Ser. Sci. Chim., 19,
753, 1971. Hammett-Streitwieser Equation: Application to Charge
Transfer Spectra of Benzenoid Hydrocarbons.
- Krygowski T. M. Bull. Acad. Sci., Ser. Sci. Chim., 19,
743, 1971. A Quantum-Chemical Interpretation of Hammett s RHO
constants: The Case of Polarographic Reversible Processes.
- Krygowski T. M., Stencel M., Galus Z., J.Electroanal.Chem.
39, 395, 1972. Polarographic and Voltametric Study of Monosubstituted
Nitro-Derivatives of Benzenoid Hydrocarbons in DMF-Interpretation
within Hammett-Streitwieser Equation and HMO Theory.
- Kruszewski J., Krygowski T. M., Tetrahedron Letters, 3839,
1972. Harmonical Oscillator Approach to the Definition of Aromaticity.
- Kamieński B., Krygowski T. M., Tetrahedron Letters, 681,
1972. Application of the Hammett-Streitwieser Equation to
Interpretation of the Chemical Shifts of Nonaromatic Protons in
Substituted Arenes.
- Krygowski T. M., J. Electroanal. Chem. 39, 436, 1972. An
Empirical Equation of 1,2- and 1,4-Naphtoquinones in the Presence of
Ion Paring Phenomena
- Krygowski T. M., Tetrahedron, 28, 491, 1972. Towards the
Unification of the Substituent (Position) Constants in Hammett-
Streitwieser Equation.
- Kruszewski J., Krygowski T. M., Bull. Acad. Polon. Sci
Ser., Sci Chim., 20, 993, 1972. An Empirical Approach to the Definition
of Aromaticity of the Benzenoid Hydrocarbons- Application of the
Hammett-Streitwieser Equation.
- Kruszewski J., Krygowski T. M., Bull. Acad. Polon. Sci
Ser., Sci Chim., 20, 907, 1972. Definition of Aromaticity Based on the
Harmonic Oscillator Model.
- Kruszewski J., Krygowski T. M., Soc. Sci. Lodz.Acta
Chimica, 18, 35, 1973. An Attempt to Verification of the Aromaticity
Indices.
- Krygowski T. M., Lipsztajn M., Galus Z.,
J.Electronical.Chem. 41, 261, 1973. Ion Pair Formation Effects in the
Revesible Electroreduction of Nitrobenzene in DMF.
- Krygowski T. M., Kruszewski J., Bull.Acad.Polon.Sci., Ser.
Sci. Chim., 21, 409, 1973. Bond Reactivity Index (BRI) in Terms of
Harmonic Oscillator Theory.
- Krygowski T. M., Kruszewski J., Bull. Acad. Polon. Sci.,
Ser. Sci. Chim., 21, 509, 1973. Aromaticity of Annulenes in Terms of
some Theoretical and Experimental Indices of Aromaticity.
- Krygowski T. M., J. Mol. Struct., 17, 168, 1973. CC-bond
Lengths in Radicals Molecules from ESR-spectral Data.
- Tomasik P., Krygowski T. M., Bull. Acad. Polon. Sci., Ser.
Sci. Chim., 22, 443, 1974. Hammett- Type Approach to the Substituent
Effects in the UW Absorption Spectra of Aromatic Compounds. Part I. The
Spectra of para-Disubstituted Benzene Derivatives.
- Tomasik P., Krygowski T. M., Chellahatturai T., Bull.
Acad. Polon. Sci., Ser. Sci. Chim. 22, 877, 1974. Part.II. The Spectra
of meta-Disubstituted Benzene Derivatives.
- Tomasik P., Krygowski T. M., Bull. Acad. Polon. Sci., Ser.
Sci. Chim .22, 1065, 1974. Part III. The Spectra of ortho-Disubstituted
Benzene Derivatives.
- Krygowski T. M., Kruszewski J., Bull. Acad. Polon. Sci.,
Ser. Sci. Chim .22, 1059, 1974. Application of the Hammett-Streitwieser
Equation to the Prediction of para-Bond Location in the UV Spectra of
Benzenologues of Perylene and Fluoranthenes.
- Krygowski T. M., Kruszewski J., Bull.Acad.Polon.Sci., Ser.
Sci. Chim., 22, 871, 1974. Aromaticity of Tiophene, Pyrrole and Furan
in Terms of Aromaticity Indices and Hammett RHO Constants.
- Lipsztajn M., Krygowski T. M., Galus Z.,
J.Electroanal.Chem. 49, 17, 1974. Polarographic Investigations of the
Interactions between Nitrobenzene Radical Anions, Water and Univalent
Cations in DMF/ Water Mixtures.
- Krygowski T. M., Perjessy A., Bull.Acad.Polon Sci., Ser.
Sci. Chim., 22, 437, 1974. Interpretation of the Hammett RHO Constant
within the Simple HMO Theory.
- Lipsztajn M., Krygowski T. M., Laren E., Galus Z., J.
Electroanal. Chem., 54, 315, 1974. Electochemical Investigations of
Intermediate in Electro-reduction of Aromatic Nitro- and Nitroso-
Compounds in DMF. Part.I. Electro-chemical Behaviours of Azoxybenzene.
- Lipsztajn M., Krygowski T. M., Laren E., Galus Z., J.
Electroanal. Chem., 57, 339, 1974. Part II. Electrochemical Behaviour
of Nitrobenzene.
- Kruszewski J., Krygowski T. M., Can. J. Chem., 53, 946,
1975. An Extension of the Hückel 4N+2 Rule to Polycyclic Nonalternant
Conjugated Hydrocarbons.
- Krygowski T. M., Lipsztajn M., Radzikowski P., J. Mol.
Structure. 28, 163, 1975. Quantum Chemical Approach to the Ion Pair
Formation /IPF/ Equlibrium Constants of Nitrobenzene Radical Anions
with Univalent Cations and Water Molecules.
- Krygowski T. M., Fawcett R. W., J. Am. Chem. Soc., 97,
2143 1975. A Complementary Lewis Acid-Base Description of Solvent
Effects. Part.I. Ion-Ion and Ion-Dipole Interactions.
- Fawcett W.R., Krygowski T. M., Austr. J. Chem., 28, 2125,
1975. Part II. Dipole-Dipole Interactions.
- Kruszewski J., Krygowski T. M., Bull. Acad. Polon. Sci.,
Ser. Sci. Chim. 23, 821, 1975. Quasiaromaticity and
Quasiantiaromaticity. The Dewar PMO Treatment of Stabilization of some
H-Bonded Systems.
- Krygowski T. M., Fawcett W. R., Can. J. Chem. 53, 3622,
1975. Separation of the Enthalpic and Entropic Contribution to
Substituent Effect from the Ionization Equlibria Constant of Aromatic
Acids.
- Fawcett W. R., Krygowski T. M., Can. J. Chem., 54, 3883,
1976. A Characteristic Vector Analysis of Solvent Effects for
Thermodynamic Data.
- Fawcett R.W., Krygowski T. M., J. Electroanal. Chem., 77,
47, 1977. Separation of the Enthalpic and Entropic Contributions to
Substituent Effects for the Electroreduction of Organic Molecules.
- Lipsztajn M., Krygowski T. M., Galus Z., J. Electroanal.
Chem. 81, 347, 1977. Electrochemical Characteristics of Additional
/red-ox/ Systems formed during the Electroreduction of Nitroso- Azoxy-
and Azo-benzene.
- Krygowski T. M., Fawcett W. R., J. Chem. Soc. Perkin II,
2033 1977. The Analysis os Substituent Effects for Reactions not
Following the Hammett Relation.
- Lipsztajn M., Krygowski T. M., Smolarz M., Szelagowska W.,
Pol. J. Chem., 52 , 1969, 1978. Substituent Effects in Electroreduction
of Nitrobenzene in DMF.
- Krygowski T. M., Guilleme J., Wojtkowiak B., J. Chem. Soc.
Perkin II. 1143, 1979. Limitation of the Hepler Theory of the Hammett
Equation.
- Luanay G., Wojtkowiak B., Krygowski T. M., Can. J. Chem.
57, 3065, 1979. Substituent and Solvent Effects on Lewis Acidity of
para-Substituted Anilines : Symmetry of Intractions.
- Krygowski T. M. Milczarek E., Wrona P. K., J. Chem. Soc.
Perkin II, 1563, 1980. An Extension of the Kamlet-Tafft Basicity Scale
of Solvent.
- Krygowski T. M., Radomski J. P., Rzeszowiak A., Wrona P.
K., Reichardt Ch., Tetrahedron 37, 119, 1981. An Empirical Relationship
between the Elvent Strengh Parameter E and Solvent Lewis Acidity and
Basicity.
- Krygowski T. M., Więckowski T., Croat. Chim. Acta 54, 193,
1981. Analysis of the H-Bridge in Carboxylic Acids in Terms of
Stabilization Energy Derived from Bond Lengths. Non-Hammett Properties
of p-Substituted Benzoic Acids in the Crystalline State.
- Więckowski T., Krygowski T. M., Can. J. Chem., 59, 1622,
1981. Crystallographic Studies and Physicochemical properties of
π-Electron Compounds. part I. Crystal and Molecular Structure of
6-N,N-diacetyloamino Chrysene /DAAC/.
- Taniewska - Osińska, S., Kamińska - Bartel L., Piekarski,
H. and Krygowski, T. M., Can. J. Chem., 59, 817, 1981. Application of
the Hancock steric constants to interpretation of heat of solution of
benzamide in aliphatic alcohols.
- Khand M. A., Krygowski T. M., Bull. Acad. Polon. Sci.,
Ser. Sci Chim. 28, 783, 1980 [publie en mars (1982)]. The Ion-Pair
Formation between Nitrobenzene Radical Anions and Na and (C H ) in
Mixture of DMSO and Acetonitrile.
- Krygowski T. M., Guilleme J., J. Chem. Soc. Perkin II.
531, 1982. An Attempt at Interpretation of the Goulden Plot in Terms an
Isokinetic Relationship.
- Geltz Z., Kokocińska R., Zalewski R., Krygowski T. M., J.
Chem. Soc. Perkin Trans II. 1069, 1983. Thermodynamics of Benzoic Acid
Protonation.
- Krygowski T. M., Reichardt Ch., Wrona P., Wyszomirska C.,
Zielkowska U., J. Chem. Res. (S), 116, 1983. Empirical Parameters of
Lewis Basicity of Binary Solvent Mixtures. Mixtures with Methanol.
- Krygowski T. M., Anulewicz R., Kruszewski J., Acta Cryst.
B39, 732, 1983. Crystallographic Stidies and Physicochemical Properties
of π-Electron Compounds. Part III. Stabilization Energy and the Kekule
Structure Contributions Derived from Experimental Bond Lengths.
- Krygowski T. M., J.Chem.Res.(S), 238, 1984.
Crystallographic tudies and Physicochemical Properties of π-Electron
Systems. Part V. Substituent Effect on the Geometry of the Benzene Ring
in Benzene Derivatives.
- Krygowski T. M., Więckowski T., Sokołowska A., Croat.
Chem. Acta. 57, 229, 1984. Infrared and Raman Studies of Carbonyl Group
Frequencies of p-Substituted Benzoic Acids in the Crystalline State.
- Grabowski S. J., Krygowski T. M., Material Science, 9,
145, 1984. Analysis of the orientational disorder in crystals of
carboxylic acids.
- Krygowski T. M., Anulewicz R., Material Science, 9, 85,
1984. Approximate estimation of the charge transfer in EDA-complexes in
crystals : the case of 7,7,8,8-tetracyanoquinodimethane (TCNQ).
- Więckowski T., Krygowski T. M., Croat.Chem.Acta 58, 5,
1985. Crystallographic Studies and Physicochemical Properties of
π-Electron Compounds. Part. II. Crystal and Molecular Structure of
2,4-Dinitrobenzoic Acid.
- Kalinowski M. K., Krygowski T. M., Croat. Chim. Acta 58,
107 1985. Application of the LFER in Organic Electrochemistry :
Interpretation of the Hammett Reaction Constants (rho) for Processes of
Reversible Electroreduction in Aprotic Solvent.
- Krygowski T. M., Wrona P. K., Zielkowska U., Reichardt
Ch., Tetrahedron 41, 4519, 1985. Empirical Parameters of Lewis Acidity
and Basicity for Aqueous Binary Solvent Mixtures.
- Grabowski S. J., Krygowski T. M., Acta Cryst. C41, 1224,
1985. Crystallographic Studies and Physicochemical Properties of
π-Electron Compounds. Part. IV. Structure of 2,5-dinitrobenzoic acid.
- Milart P., Krygowski T. M., Can. J. Chem. 63, 3256, 1985.
Analysis of Solvent and Substituent Effects on UV and Visible Spectra
of N-/(-methylarylidene/-p-/N,N -dimethylamino - anilines.
- Karolak-Wojciechowska J., Anulewicz R., Krygowski T. M.,
Kryszewski M., Pęcherz J., Acta Cryst. C42, 172, 1986. Structure of
p-Phenylenedi-methylenebis (dimethylsulfonium)-7,7,
8,8-Tetracyano-p-quinodimethanide (1/3).
- Krygowski T. M., Häfelinger G., Schüle J., Z. Naturforsch.
41b, 895, 1986. Interpretation of Substituent Angular Parameters of
Monosubstituted Benzenes by Means of ab initio STO-3G Fully Optimized
Molecular Structures and Charge Densities. Part VI of the Series
Crystallographic Studies and Physicochemical Properties of π-Electron
Systems.
- Krygowski T. M., Häfelinger, J.Chem.Res. (S), 348, 1986.
Crystallographic Studies and Physicochemical Properties of p-Electron
Systems. Part. 10. Ab initio STO-3G Interpretation of Hammett
Substituent Constants.
- Maurin J. K., Krygowski T. M., Acta Cryst. C43, 64, 1987.
Structure of N,N-Dimethyl-2,4-dinitro-3-toluidine. Part 12 of the
Series : Crystallographic Studies and Physicochemical Properties of
π-Electron Systems.
- Anulewicz R., Häfelinger G., Krygowski T. M., Regelman C.,
Ritter., Z.Naturforsch. 42b 917, 1987. Crystallographic Studies and
Physicochemical properties of π-Electron Systems. Part VII. Refinement
of the Crystal and Molecular Structure of p-N,N-Dimethylaminobenzoic
Acid. Full ab initio STO-3G Optimization of its Molecular Geometry and
Empirical Analysis of Substituent Effects on the Geometry of Benzene
Rings in p-Substituted Benzoic Acid.
- Maurin J., Krygowski T. M., J. Mol. Struct. 158, 359,
1987. Crystallographic Studies and Physicochemical Properties of
π-Electron Systems. Patr VIII. Crystal and molecular structure of
N,N-dimethyl-4-nitro-2,6-xylidine. Application of the Walsh Rule to
p-substituted Nitrobenzenes.
- Krygowski T. M., J.Chem.Res. 120, 1987. Crystallographic
Studies and Physicochemical Properties of π-Electron Compounds. Part
13. Substituent Effect on the Geometry of the Ring in para Substituent
Benzene Derivatives with Inter- and Intra-molecular Charge Transfer.
- Anulewicz R., Krygowski T. M., Pniewska B., J. Cryst.
Spectr. Res. 661, 1987, Molecular structure od N,N-diphenylformamidine.
Part 15 of the Series: Crystallographic Studies and Physicochemical
Properties of π-Electron Systems.
- Maurin J., Krygowski T. M., Acta Cryst. C43, 2381, 1987.
Crystallographic Studies and Phiysicochemical Systems. XVI. The
Structure of N,N-Diethyl-3,4-dinitroaniline: Non-Additivity of
Substituent Effect on the Geometry of the Benzene Ring.
- Krygowski T. M., Turowska-Tyrk I., Chem. Phys. Lett. 90,
1987. Deformation Directions Obtained from Atom-Atom Potentials
Molecular Deformations in Crystals.
- 79. Firlej, L., Graja, A., Rajchel, A., Woźniak, K.,
Krygowski, T. M., Phys. Stat. Sol. (b) 140, 437, 1987, The
7,7,8,8-tetracyano-p-quinodimethanide Salt of the N-n-Propyl
Quinoxalinum Cation - Its Structure, Conductivity, and Triplet spin
Excitations.
- Maurin J., Krygowski T. M., J. Mol. Stuct. 172, 413, 1988.
Crystallographic Studies amd Physicochemical Properties of π-Electron
Systems. Part XIV. Crystal and Molecular Structure of
N,N-dimethyl-p-nitroaniline.
- Turowska-Tyrk I., Krygowski T. M., Gdaniec M. Häfelinger
G., Ritter G., J.Mol.Struct. 172, 401, 1988. Crystallographic Studies
and Physico-chemical Properties of π-Electro Compounds. Crystal and
Molecular Structure of Sodium p-nitrobenzoate Trihydrate.
- Krawiec M., Krygowski T. M. & Zakrzewski A., Acta
Cryst., C45, 345, 1989. Structure of phenacyl phenyl sulfone.
- Grabowski S. J. & Krygowski T. M., Croatica Chemica
Acta, 62, 485, 1989. Effect of the orientational on the observed
geometry of carboxylic group in dimers of carboxylic acids in
crystalline state.
- Krygowski T. M. & Maurin J., J.Chem.Soc. Perkin Trans
II,) 695, 1989. Crystallographic studies off intra and inter-molecular
interactions. Crystal and molecular structure of
N,N-dimethyl-p-nitro-3,5-xylidine. Structural evidence against the
classical through-resonance concept in p-nitroaniline and derivatives.
- Gdaniec M., Turowska-Tyrk I. & Krygowski T. M., J.
Chem. Soc. Perkin Trans II.), 613, 1989. Crystal and molecular
structure of pyrylium salts. Part 1. crystal and molecular structure of
2,6-diphenyl-4(2-phenylpropan-2-yl)pyrylium perchlorate and aromaticity
of the pyrylium ring..
- Häfelinger G., Regelman C. U., Krygowski T. M. &
Wozniak K., J. Comput. Chem. (.10, 329, 1989. Basis set Dependence,
precision and Accuracy of full ab initio gradient optimization of
molecular structures of nonstrained hydrocarbons. I.CC bond lengths.
- Krygowski T. M., Woźniak K., Bock Ch. W., George P., J.
Chem. Res. (s), 396, 1989. Correlation of Hammmett Substituent
constants with charge densities calculated using the 6-31G (5D) basis
set.
- Woźniak K., Krygowski T. M., J. Mol. Struct., 193, 81,
1989. Crystallographic studies and physicochemical properties of
π-electron systems. Part XVIII. Crystal and molecular structure of
N-n-propyl-quinioxaline 7, 7', 8, 8'-tetracyano-p- quinodimethane:
estimation of charge at TCNQ by the HOSE model.
- Wrona P. K., Krygowski T. M. and Zielkowska U., Z.
Natuforsch. 44b, 673, 1989 , Empirical Parameters of Lewis Basicity of
Binary Solvent Mixtures. Part II Mixtures with water..
- Krygowski T. M. & Turowska-Tyrk I., Collect. Czech.
Chem. Commun. 55, 165, 1990. Crystal and molecular structure of
potassium p-nitrophenolate monochydrate: substituent effect on geometry
of the ring in p-substituted nitrobenzene derivatives.
- Krygowski T. M. & Turowska-Tyrk I., Pol. J. Chem. 64,
89, 1990. Crystallographic studies and physicochemical properties of
π-electron compounds. Part XXII. Dependence of the reliability and
predictive power of the Δ vs α. Plot for monosubstituted benzene
derivatives on the quality of data sets.
- Krygowski T. M., Anulewicz R., Daniluk T., & Drapała
T., Struct. chem. 1, 371, 1990, Crystallographic studies on sterically
affected chemical species. Part 1. crystal and molecular structure of
2-carboxy-2'-methoxy-biphenyl. Definition of repulsive deformation
parameters and angular consequences in geometry of systems with
sterically interacting substituents.
- Grabowski S., Krygowski T. M., Häfelinger G., Ritter G.,
Acta Cryst, C46, 428, 1990. Crystallographic Studies and
Physicochemical Properties of π-Electron Compounds. XVII. the structure
of p-nitrophenylacetic acid.
- Wozniak K., Krygowski T. M., Kariuki B. & Jones W.,
Acta Cryst.C46, 1946, 1990, Structure of 2,3-dimethylquinoxaline.
- Woźniak K., Krygowski T. M., Kariuki B., Jones W., Grech
E., J. Mol. Struct. 240, 119, 1990, Crystallographic studies of intra-
and inter-molecular interactions. Part IV. Molecular and crystal
structure of phthalazine semitetrafluoroborate: intramolecular changes
in geometry as a conseqience of H-bonding.
- Woźniak K., Krygowski T. M., Kariuki B., Jones W., Grech
E., J.Mol.Struc. 240, 111, 1990 Crystallographic Studies on Sterically
Affected Chemical Species. Part II. Molecular and crystal structure of
1,8-bis (dimethylamino)-naphthalene tetrafluoroborate. Analysis of
distorsion of geometry in the aromatic part due to intramolecular
hydrogen bonding.
- Anulewicz R., Krygowski T.M., & Pniewska B., Acta
Cryst. C46, 2121, 1990, Crystallographic Studies and Physicochemical
Properties of π-Electron Systems. Part 21. Structure of N,N'-bis
(p-chlorophenyl) formamidine.
- Krygowski T. M., Kalinowski M. K., Turowska-Tyrk I.,
Hiberty P. C. Milart P, Silvestro A., Topsom R. D., Daehne S.,
Struct.Chem. 2, 71, 1991. Crystallographic Studies of Intra and
Intermolecular Interactions. Part 4. A Comparative Study of the Effect
of Through- Resonance on the Geometry of p-Nitro and p-Nitrosophenolate
Anions.
- Krygowski T. M., Anulewicz R., Pniewska B.,Milart P., J.
Phys. Org. Chem. 4, 121, 1991. Crystal and Molecular Structure of
Pyrylium Salts. IV. Crystal and Molecular Structure of
2,6-Diphenyl-4(4-carboxyphenyl)-Pyrylium Perchlorate. Interrelations
between structural parameters due to substituent effects.
- Turowska-Tyrk I., Krygowski T. M., Milart P., Butt G.,
Topsom R.D., J. Mol. Struct. 245, 289 1991. Crystal and molecular
structure of pyrylium salts. Part II. Crystal and molecular structure
of 2,6-diphenyl-4 (4-nitrophenyl)-pyrylium perchlorate nitromethane
solvate, electronegativity effect on geometry of the cation.
- Anulewicz R., Krygowski T. M., Raczynska E., Laurence Ch.,
J. Phys. Org. Chem. 4, 331, 1991. Crystallographic studies of inter-
and intramolecular interactions. Part VI. Crystal and molecular
structure of N,N'-dimethyl-N'- phenylsulphonylformamidine. Equalization
of CN bond lengths in the amidine fragment as a result of substituent
effects due to push-pull.
- Anulewicz R., Krygowski T. M., Jaroszewska-Manaj J.,
Pniewska B., Pol. J. Chem. 65, 465, 1991. Crystallographic studies and
physicochemical properties of π-electron systems. Part XX. Crystal and
molecular structure of N,'-di-(p-bromophenyl)- formamidine.
- Woźniak K,. Krygowski T. M., Kariuki B., Jones W., J. Mol.
Struct. 248, 331, 1991. Crystallographic studies of intra- and
intermolecular interactions. Part VII. Crystal and molecular structure
of the complex of acridine-pentachloro phenol: H-bonding effect on the
geometry of the pentachloropenol moiety.
- Woźniak K., Krygowski T. M., Filipek S., Acta Cryst. C47,
1326 1991. Structure of 6,7-Dimethyl-2,3-diphenlquinoxaline.
- Krawiec M. Krygowski T. M., J.Mol.Struct. 246, 113, 1991.
Crystallographic stuies of intra- and intermolecular interactions. Part
III. Refinement of the crystal and molecular structure of
N,N-dimethyl-m-nitroaniline: additivity of substituent effects on
geometrical paramaters of the ring.
- Krygowski T. M., Anulewicz R., Raczyńska E., Laurence Ch.,
J. Phys. Org. Chem. 4, 689 1991. Structural studies of
1,3-di(N,N-dimethyl-formamidyl)-2-cyanoguanidine. The case of a
strongly Lewis Basic nitrogen atom in the cyano group. VIII.
Crystallographic studies of intra- and intermolecular interactions.
- Wrona P. K., Krygowski T. M., Galus Z., J.Phys.Org.Chem.
4. 439 1991. Correlation between empirical Lewis acid-basesolvent
parameters and the thermodynamic parameters of ion solvation. Part II.
Acidity parameters of cations and basicity parameters of anions.
- Turowska - Tyrk, I., Krygowski, T.M., Milart, P., J. Mol.
Struct. 263, 235, 1991. Crystal and molecular structure of pyrylium
salts. Part III Crystal and molecular structure of 2,6-diphenyl -4
(4-N, N-dimethylaminophenyl)-pyrylium perchlorate: a case of a long
distance substituent effect on geometry of the oyrylium ring.
- Oonishi I., Ohshima S.,Fujisawa S., Aoki J., Ohashi Y.
Krygowski T. M., J.Mol.Struct. 265, 283, 1992. Conformation of
condensed polycyclic aromatic hydrocarbons. Part III. The molecular an
crystal structure of tribenzo
[a,h,rst]phenanthra[1,2,10-cde]pentaphene: a simple analysis of the
in-plane distorsions due to overcrowding.
- Krygowski T. M., J. Chim. Phys. 89, 1609, 1992. Crystallo-
graphic studies of inter and intamolecular interactions affecting
aromatic character of π-electron systems.
- Turowska-Tyrk I., Anulewicz R., Krygowski T. M., Pniewska
B, Milart P., Pol. J. Chem. 66, 1831, 1992. Crystal and molecular
structure of pyrylium salts. Part V. Crystal and molecular structure of
2,6-diphenyl4 (4-hydroxyphenyl)- and
2,6-diphenyl-4(4-methylphenyl)-pyrylium perchlorates.
- Häfelinger G., Krygowski T. M., Kuske F., Z. Naturforsch.
47b, 1480, 1992. Ab initio 3-21G calculations of push-pull interactins
of substituents at imino-nitrogen in formamidines. Non-equivalence of
NO-bonds of the nitro-substituents.
- Woźniak K., Krygowski T. M. Grech E., J.Mol.Struct. 274,
145, 1992. Disordered H-bonding in phthalazine 1-methyl-5-tetra-
zolethione.
- Boese R., Blaser D., Nussbaummer M., Krygowski T. M.,
Struct. Chem. 3, 363, 1992. Low temperature crystal and molecular
structure of nitrobenzene.
- Krygowski T. M., J. Inf. Comput. Sci., 33, 70, 1993.
Crystallo- graphic studies of inter- and intramolecular interactions
reflected in aromatic character of π-electron systems.
- Woźniak K., Krygowski T. M., Grech E., Kołodziejski W.,
Klinowski J., J. Phys. Chem.), 97, 1862, 1993. Hydrogen bonding and the
structural substituted quinoxaline: solid-state NMR and single-crystal
X-ray diffraction studies.
- Anulewicz R., Krygowski T. M., Gawinecki R., Rasała D., J.
Phys. Org. Chem., 6, 257, 1993. Crystal and molecular structure of
N-nitro-N-methyl-p-nitroaniline analysis of substituent effects on the
ring geometry and estimation of the Hammett substituent constant for
the N-methylnitramino group.
- Woźniak K., Krygowski T. M., Gawinecki R., Pol. J. Chem.
67, 1175, 1993.Crystal and molecular structure of N-(4'-dimethyl
aminobenzylidene-amino)-3-nitropyridinium perchlorate. Aromaticity of
phenylic and pyridinium rings studied by analysis of geometry.
- Woźniak K., Krygowski T. M., Pol. J. Chem. 67, 1667, 1993.
Structural features of lithium-oxygen bond retrieved for ionic crystals
from Cambridge Structural Database and Inorganic Structural data base".
- Kuhch N. D., Majchrzak I., Ciesielski W., Graja A.,
Woźniak K., Krygowski T. M., J. Phys. I France, 1987, 1993. New
sulfur-fullerite; its preparation, structural and spectral properties.
- Woźniak K., Krygowski T. M., Grech E., Nowicka-Scheibe J.,
Pol. J. Chem. 68, 768, 1994. Desymmetrization of naphthalene moiety as
a result of different substitution at peri positions.
- Dziembowska T., Szczodrowska B.,Krygowski T. M., Grabowski
S. J., J. Phys. Org. Chem., 7, 142, 1994. Estimation of the OH...O
interaction energy in intramolecular hydrogen bonds: a comparative
study.
- Woźniak K., Krygowski T. M., Grech E., Pol. J. Chem., 68,
1813, 1994. Structural consequences of protonotion in substituted
quinoxalines.
- Krygowski T. M., Anulewicz R., Pniewska B., Milart P.,
Bock Ch. W., Sawada M., Takai Y., Hanafusa T., J.Mol.Struct. 324, 251,
1994. Crystal and molecular structure of the lithium p-nitrosophenolate
dihydrate dimer: an example of strong dependence of the (-electron
cooperative substituent effect on the hydrogen-bonding network in the
crystal lattice.
- Krygowski T. M., Ciesielski A., Świrska B., Leszczyński
P., Pol. J. Chem., 68, 2097, 1994. Variation of Molecular Geometry and
Aromatic Character of chrysene and perylene in their EDA complexes.
refinement of X-ray crystal and molecular structure of chrysene and
perylene.
- Krygowski T. M., Anulewicz R., Jarmula A., Bak T., Rasala
D., Howard S. T., Tetrahedron, 46, 13155, 1994. The effect of the
methoxy group on the geometry of the benzene ring supported by crystal
structure studies and ab initio calculations. Crystal and molecular
structure of 4-(4-methoxy phenyl)-2,6-diphenylpyridine and
1-methyl-4-(4-methoxy- phenyl) -2,6-diphenylpyridinium-perchlorate.
- Krygowski T. M., Anulewicz R., Milart P., Zimmermann T.,
J. Prakt. Chem., 336, 1994. Crystal and molecular structure of
2,6-diphenyl-4 -carboxypyrylium perchlorate and of
5,6,7,8-tetrahydro-8-oxo- 2,6-diphenyl -1-benzopyrylium perchlorate. A
mutual correlation between structural parameters for symmetrically
substituted pyrylium rings.
- Anulewicz R., Bąk T., Cyrański M., Krygowski T. M., Rasała
D., Świrska B., Polish J. Chem., 69, 597, 1995. Substituent effect on
pyridine and benzene rings in some 4-aryl-2,6-diphenylpiridines.
Crystal and molecular structure of methyl - and fluoro derivatives.
- Krygowski T. M., Ciesielski A., J. Chem. Inf. Comput Sci.,
35, 203, 1995. Aromatic character of benzene ring present in various
topological environments in benzenoid hydrocarbons. Nonequivalence of
indices of aromaticity.
- Krygowski T. M., Anulewicz R., Pniewska B., Bock C. W.,
Pol. J. Chem, 69, 723, 1995. Comparative study of substituent effect in
para- and meta- nitrophenolate anions. Crystal and molecular structure
of sodium m-nitrophenolate dihydrate and related ab initio
calculations.
- Cyrański M., Krygowski T. M., Pol. J. Chem., 69, 1080,
1995. Structural studies of disubstituted benzene derivatives. Part I.
Factor analysis study of the molecular geometry in para-disubstituted
benzene derivatives.
- Cyranski M., Krygowski T. M., Pol. J. Chem., 69, 1088,
1995, Structural studies of disubstituted benzene derivatives. Part II.
Factor and regression analyses of aromaticity of the ring in
para-disubstituted benzene derivatives.
- Anulewicz R., Bąk T., Cyrański M., Krygowski T. M., Pawlak
D., Pniewska B., Rasała D., Gawinecki R., Acta Chem. Scand., 49, 515,
1995. Substituent effect on the geometry of the pyridine ring
in1-methyl-4-(-4-R-phenyl)-2,6-diphenylpyridinium perchlorates.
- Krygowski T. M., Anulewicz R., Wisiorowski M., Pol. J.
Chem., 69, 1579, 1995. Derivation of the Kekul( contributions from
experimental bond lengths for π-electron systems with NN nad NO nonds.
Extension of the HOSE model.
- Irle S., Krygowski T. M., Niu J.E., Schwarz W.H.E., J. Org.
Chem., 60, 6744, 1995. Substituent Effects of -NO and -NO2 Groups in
Aromatic Systems.
- Krygowski T. M., Ciesielski A., Cyrański M., Chemical
Papers, 49 128, 1995. Aromatic character and energy of the five- and
seven- membered rings in derivatives of penta- and heptafulvene
substituted in exocyclic position.
- Krygowski T. M., Ciesielski A., J. Chem. Inf. Comput Sci.,
35, 1001, 1995. Local aromatic character of C60 and C70 and their
derivatives.
- Krygowski T. M., Cyrański M., Tetrahedron, 52, 1713,1996.
Separation of the energetic and geometric contributions to the
aromaticity of -electron carbocyclics.
- Krygowski T. M., Ciesielski A., Cyrański M., J. Mol.
Struct., 374, 277, 1996. Aromatic character of the cyclopentadienyl
moiety embeded in various chemical envinronments: a statistical
treatment of the structuraldata.
- Krygowski T. M., Cyrański M., Ciesielski A., Świrska B.,
Leszczyński P., J. Chem. Inf. Comput. Sci, 36, 1135,1996, Separation of
the Energetic and Geometric Contributions to Aromaticity. 2. Analysis
of the Aromatic Character of Benzene Rings in Their Various Topological
Enviroment in the Benzenoid Hydrocarbons. Crystal and Molecular
Structure of Coronene.
- Cyrański M., Krygowski T. M., J. Chem. Inf. Comput. Sci.,
36, 1142, 1996. Separation of the Energetic and Geometric Contributions
to Aromatici-ty. Part 3. Analysis of the Aromatic Character of Benzene
Rings in Their Various Topological and Chemical Enviroments in the
Substituted Benzene Derivatives.
- Krygowski T. M., Cyrański M., Wisiorowski M., Pol.J.Chem.,
70, 1351, 1996. Through Space Substituent Effects Shedding Light on
Aromaticity. Energetic and Geometric Contributions to Aromaticity.
- Krygowski T. M., Cyrański M., Tetrahedron, 52, 10255, 1996
Separation of the Energetic and geometric Contributions to the
Aromaticity. Part .IV. A General Model for the π-Electron Systems.
- Krygowski T. M., Wisiorowski M., Nakata K., Fujio M.,
Tsuno Y., Bull. Chem. Soc. Jpn., 69, 2275, 1996. Changes of the
Aromatic Character of the Ring in Exocyclically Substituted Derivatives
of Benzylic Cation as a Result of Varying Charge at the exo-Carbon
Atom.
- Howard S. T., Krygowski T. M., Glówka M. L., Tetrahedron,
52, 11379, 1996.The Imbalanced Kekule Structure Contributions in the
Ring in 1,3,5-trisubstituted Benzene Derivatives: Low Temperature X-Ray
Study on 1,3,5-trimethoxybenzene, and ab initio Calculations on
1,3,5-triformylo-benzene and trimethoxy-benzene and the Related
Di-substituted Systems.
- Krygowski T. M., Pawlak D., Anulewicz R., Rasala D.,
Gawinecki R., Hafelinger G., Homsi M. N., Kuske F. K. H., Acta
Chem.Scand., 50, 808, 1996. Resonance Interactions in the N-Nitramino
Group. X-Ray Study of α-, β- and γ-Nitraminopyridines.
- Cyrański M., Krygowski T. M., Tetrahedron, .52, 13795,
1996. Separation of the energetic and Geometric Contributions to the
Aromaticity of π-Electron Carbocyclics.Part.V. Analysis of the Aromatic
Character of Aza-Analogues of benzenoid Hydrocarbons.
- Krygowski T. M., Anulewicz R., Hiberty P. C., J. Org.
Chem., 61, 8533, 1996. Structural Consequences of the Substituent
Nonsymmetry on the Geometry of the benzene Ring. Analysis of the
Molecular Geometry of Diazo-Derivatives of Benzene.
- Albert K., Hafelinger G., Milart P., Krygowski T. M., Kuhn
T., Pusch M., Strohschein S., Z.Naturforsch. 52b, 263, 1997.
Conformational Aspects of the p-Nitrosophenolate Anion and Related
Compounds: NMR Study and ab initio 6-31G Optimizations of Molecular
structures.
- Krygowski T. M., Howard S. T., Martynowski D., Główka M.
L., J.
Phys.Org.Chem., 10, 125, 1997. Imbalance of the Kekule Structures in
2,4,6-Trimetoxy-S-Triazine.
- Krygowski T. M., Cyrański M., Nakata K., Fujio M., Tsuno
Y., Tetrahedron, 53, 11383, 1997. Separation of the Energetic and
Geometric Contribitions to Aromaticity. Part VI. Changes of the
Aromatic Character of the Rings in Naphthalene, Antracene, Phenanthrene
and Pyrene Derivatives Induced by the Charged Substituent CH2+..
- Krygowski T. M., Wisiorowski M., Howard S. T., Stolarczyk
L. Z., Tetrahedron 53, 13027, 1997. Angular-Group-Induced Bond
Alternation. I. Origin of the Effect from Ab-Initio Calculations.
- Krygowski T. M., Chem. Listy, 91, 616, 1997. Angular Group
Induced Bond Alternation (AGIBA) - A New Type of the Substituent
Effect.
- Howard S. T. and Krygowski T. M., Can. J. Chem., 75, 1174,
1997. Benzenoid Hydrocarbon Aromaticity in Terms of Charge Density
Descriptors.
- Woźniak K., Krygowski T. M., Pawlak D., Kołodziejski W.
and Grech E., J. Phys. Org. Chem., 10, 814, 1997.Solid State NMR and
X-Ray Diffraction Studies of Ionic Complex of 1,8-bis (dimethylamino)
naphthalene (DMAN) with Picrolic Acid.
- Anulewicz R., Wawer I., Krygowski T. M., Mannele F. and
Limbach H.-H., J. Am. Chem. Soc. 119, 12223, 1997. Combined X-ray
diffraction and 15N CPMAS NMR study of molecular structure and proton
order/disorder phenomena in cyclic N,N'-bisaryloformamidine dimers.
- Krygowski T. M., Woźniak K., Anulewicz R., Pawlak D.,
Kołodziejski W., Grech E. and Szady A., J. Phys. Chem., 101, 9399,
1997. Through-Resonance Assisted Ionic Hydrogen Bonding in
5-Nitro-N-salicydeneethylamine.
- Cyranski M. K., Krygowski T. M., Wisiorowski M.,.van
Eikema Hommes N. J. R and Schleyer P. v. R., Angew. Chem. Int. Ed., 37
, 177, 1998. Global and Local Aromaticity in Porphyrines: An Analysis
Based on Molecular Geometries and Nucleus-Independent Chemical Shifts.
- Cyranski M. K., Krygowski T. M., Wisiorowski M., Eikema
Hommes N. J. R.van and Schleyer P. v. R., Angew. Chem. 110, 187, 1998.
Globale und lokale Aromatizitat in Porphyrinrn: eine Analyse anhand von
Molekulgeometrien und kerneunabhangigen chemischen Verschiebungen.
- Howard S. T., Krygowski T. M., Ciesielski A. and
Wisiorowski M., Tetrahedron, 54, 3533, 1998. Angular Group Induced Bond
Alternation II The Magnitude and the Nature of the Effect and its
Application to Polynuclear Benzenoid Systems.
- Anulewicz R., Krygowski T. M. and Jagodziński T., Pol. J.
Chem., 72, 439, 1998. The Crystal and Molecular Structure of Cyclic
Thioamide β-Diketone Derivatives. Intramolecular H-Bonding and the
Problem of Quasiaromaticity.
- Krygowski T. M., Cyrański M., Nakata K., Fujio M., Tsuno
Y., Tetrahedron. 54, 3303, 1998. Separation of the Energetic and
Geometric Contribitions to Aromaticity.Part VII. Changes of the
Aromatic Character of the Rings in Naphthalene Induced by the Charged
Substituent CH2+. The Dependence on the Position of the Substituent,
Torsion Angle and the Exocyclic Bond Length Variation.
- Jarmuła A., Anulewicz R., Leś A., Cyrański M. K.,
Adamowicz L., Bretner M., Felczak K., Kulikowski T., Krygowski T. M.
and. Rode W., Biochim. Biophys. Acta, 1382, 277, 1998. Crystal
Structure of 5-fluoro-dUrd and its 2 and/or 4-thio analogues: models of
substituted dUMP pyrimidine ring interacting with thymildylate
synthase.
- Cyranski M.K., Krygowski T. M. and Bird C.V., Tetrahedron,
54, 9711, 1998. Separation of the Energetic and Geometric Contribitions
to Aromaticity, Part VIII Changes in Aromaticity and the Evidence for
the Multidimensionality of of the Aromatic Character of Benzene ring in
Para- and Meta-Cyclophanes.
- Jarmuła A., Cyrański M. K., Leś A., Krygowski T. M., Rode
W., Pol. J. Chem., 72, 1958, 1998. Interaction of Thymidylate Synthase
with 5-Fluoro- Substituted DUMP Analogues in View of the Pyrimidine
Ring Structure.
- Krygowski T. M., Anulewicz R., Cyrański M. K., Puchała A.
and Rasała D., Tetrahedron, 54, 12295, 1998. Separation of the
Energetic and Geometric Contribitions to Aromaticity. Part IX.
Aromaticity of Pyrazoles in Dependence on the Kind of Substitution.
- Krygowski T. M., Piętka E., Anulewicz R., Cyrański M. K.
and Nowacki J., Tetrahedron, 54, 12289, 1998. Angular Group Induced
Bond Alternation. Part III. The Case of o-Dimethoxy Derivatives.
Crystal and Molecular Structure of
3,4-dimethoxybenzaldehyde(4-metylphenyl)sulphonyl]hydrazone.
- Katritzky A. R., Karelson M., Sild S., Krygowski T. M. and
Jug K., J. Org. Chem., 63, 5228, 1998. Aromaticity as a Quantitative
Concept: Part 7 Aromaticity Reaffirmed as a Multidimensional
Characteristic.
- Krygowski T. M., Grabowski S. J., Konarski J., Tetrahedron,
54, 11311, 1998,. Water Molecules as a Gluing Factor in Organic
Crystals and Biological Systems.
- Cyranski, M.K. and Krygowski, T.M., Tetrahedron, , 54, 14
919, 1998. Separation of the Energetic and Geometric Contribitions to
Aromaticity. Part X. The Case of Benzene Rings in Fused Polycyclic
Benzenoid Hydrocarbons.
- Madura I. D., Krygowski, T. M. and Cyranski M. K.,
Tetrahedron, 54, 14 913, 1998. Structural Aspects of the Aromaticity of
Cyclic pi-electron systems with BN Bonds.
- 172. Grabowski, S. J. and Krygowski, T. M., Tetrahedron,
54, 5683 - 5694, 1998, Estimation of the Proton Position and the Energy
of O-H�O Bridges in Crystals from X-Ray Diffraction Data.
- Micuch, P., Fisera, L., Cyranski M.K. and Krygowski, T.M.,
Tetrahedron Letters, 167, 1999. Reversal of Stereoselectivity of Mg(II)
Catalysed 1,3-Dipolar Cycloaddition. Acceleration of Cycloaddition by
Microwave Irradiation.
- Krygowski, T.M., Stępień, B., Anulewicz, - Ostrowska, R.,
Dziembowska, T., Tetrahedron, , 55, 5457, 1999. π - Electron
Delocalisation in the Spacer of the )-H...N Bridge in Schiff Bases.
Crystal and Molecular Structure of
3,5-dimethoxy-2[(phenylimino)methyl]methyl]phenol and
4-methoxy[(phenylimino) methyl]phenol.
- Cyranski, M.K. and Krygowski, T.M., Tetrahedron, 55, 6205,
1999. Two Sources of the Decrease of Aromaticity: Bond Length
Alternantion and Bond Elongation. Part 1. An Analysis Based on Benzene
Ring Deformations
- Cyranski, M.K. and Krygowski, T.M., Tetrahedron, 55,11
143, 1999. Two Sources of the Decrease of Aromaticity: Bond Length
Alternantion and Bond Elongation. Part 2. An Analysis Based on Geometry
of the Singlet and Triplet States of 4nπ Annulenes.
- Grabowski, S.J. and Krygowski, T.M., Chem. Phys. Lett.,
305, 247, 1999. The Proton transfer path for C=O...H-O Systems Modelled
from Crystal Data.
- Anulewicz - Ostrowska R., Piętka, E., Krygowski, T.M.,
Micuch, P. and Fisera L., Pol. J. Chem., 40, 167, 1999. Crystal and
Molecular Structure of
3-(2,4,6-trimethyl)8-phenyl-oxo-1,7-dioxa-2-azaspiro[4,4]non-2-ene.
- Anulewicz - Ostrowska R., Krygowski, T.M., Cyranski, M.K.,
Matuszewska M.P., Pol. J. Chem., 73, 1895, 1999. Crystal and Molecular
Structure of 1,3,5-trimethoxy-2,4,6-trinitrobenzene. Mesomeric Effects
for Out-of-plane Twisted Substituents.
- Krygowski, T.M., Stępień, B., Anulewicz - Ostrowska, R.,
Cyrański, M.K., Grabowski, S.J., Rozwadowski, Z. And Dziembowska, T.,
Coll. Czech. Chem. Commun, 64, 1797, 1999. Crystal and Molecular
Structure of N-(3,5-dichloro-2-hydroxybenzylidene) - and
N-(2-hydroxy-3-methoxybenzylidene)aniline oxides. Delocalization in the
spacer of the intramolecular H-bond and the problem of
quasiaromaticity.
- Slezak, R., Krutosikova, A., Cyranski, M.K., Krygowski,
T.M. Pol. J. Chem., 74, 207, 2000. Furo[2,3-b]pyrrole Derivatives.
Syntheses and Reactions in the Furan and Pyrrole Ring.
- Krygowski, T.M., Pindelska, E., Cyrański, M.K., Grabowski,
S.J., Tetrahedron, 56, 8715, 2000. Angular Group Induced Bond
Alternation (AGIBA) Part 4. Does the Effect Operate in the Systems with
Alternated Bonds?
- Grabowski, S.J., Krygowski, T.M., Stępień, B., Reaction
pathway of proton transfer from the neautral to zwitterionic forms of
amino acids. Support for a water molecule-mediated mechanism. J. Phys.
Org. Chem., 13, 740, 2000.
- Kolehmainen, E., Ośmiałowski, B., Krygowski, T.M.,
Kauppinen, R., Nissinen, M., Gawinecki, R., J.Chem. Soc. Perkin 2,
2000, 1259. Substituent and temperature controlled tautomerism:
multinuclear magnetic resonance, X-ray,and theoretical studies on
2-phenacylquinolines,
- Micuch, P. and Fisera L., Cyrański, M. K., Krygowski,
T.M., Krajcik, J., Tetrahedron, 56, 5465, 2000. Reversal of
diastereoselectivity of nitrile oxide 1,3-dipolarcycloaddition by
Mg(II). Acceleration of cycloaddition by microwave irradiation.
- Cyrański, M.K., Stepien, B., Krygowski, T.M., Tetrahedron,
56, 5465, 2000. Global and local aromaticity of linear and angular
polyacenes.
- Krygowski T. M., Pindelska E., Anulewicz - Ostrowska R.,
Grabowski S. J., Dubis A. T., J. Phys. Org. Chem., 14, 349, 2001.
Angular Group-induced bond alternation (AGIBA), Part 5. Conformational
dependence and additivity of the effect: structural studies of
3,5-dimethoxybenzaldehyde derivatives and related systems.
- Stępień, B. T., Cyrański, M. K., Krygowski, T. M., Chem.
Phys. Lett. 350, 537, 2001. Aromaticity strongly affected by
substituents in fulvene and heptafulvene as a new method of estimating
the resonance effect.
- Temeriusz A., Anulewicz R., Wawer I., Krygowski T. M.,
Piekarska - Bartoszewicz B., Rowinska M., Carbohydrate Res., 334, 71-
79, 2001. Crystal structure and solid state 13C NMR analysis of
N-(methyl 3,4,6-tri-O-acetyl- , and -D-glucopiranosid-2-yl)oxamide
derivative of p-chloroaniline, N,N-diethyl-amine, N-methylaniline and
N-ethylaniline.
- Witkowski S., Anulewicz - Ostrowska R., Krygowski T. M.,
Pol. J. Chem., 75, 883, 2001. Water molecules as a gluing factor in
organic crystals. Part 2. The crystal and molecular structure of
6-acetoxy-2,5,7,8-tetramethylchroman-2-carbocyclic acid monohydrate.
- Krygowski T. M., Cyrański M. K., Anulewicz - Ostrowska R.,
Pol. J. Chem., 75, 000, 2001. Guanidinium cation - an acyclic analogue
of benzene?
- Pindelska E., Krygowski T. M., Anulewicz - Ostrowska R.,
Cyrański M.K., Nowacki J., J. Phys. Org. Chem., 14, 764, 2001. Angular
Group-Induced Bond Alternation (AGIBA), Part 6, Competition between the
AGIBA and Through Resonance Effects.
- Krygowski T. M., Lambert J. B., J. Phys. Org. Chem., 14,
727, 2001. Editorial to the special issue dedicated to Dr John Shorter
on the occasion of his 75th, birthday.
- Cyrański M. K., Krygowski T. M., Krutosikova A., Slezak R.,
Tetrahedron, 57, 8867, 2001. Aromaticity of Dihetero Analogues of
Pentalene Dianion. X-ray and ab-initio Studies of Eight Methyl
Furo[3,2-b]pyrrole-5-carboxylate Derivatives and Five Methyl
Furo[2,3-b]pyrrole-5-carboxylate Derivatives.
- Krygowski T. M., Pindelska E., Pol. J. Chem., 76, 325,
2002. Angular Group-Induced Bond Alternation (AGIBA), Part VII. The
Case of a Branched substituent - the carboxylic group.
- Krygowski T. M., Grabowski S. J., Anulewicz - Ostrowska R.,
Izdebski J., Fiertek D., Pol. J. Chem., 76, 129, 2002. An empirical
estimation of the interactions H+...Cl-. The crystal and molecular
structure of the
1-methyl-2-tertbutyloamino-4-isopropyl-5(4H)-imidazolone hydrochloride.
- Cyrański, M. K., Krygowski, T. M., Katritzky A. R.,
Schleyer, P. v. R., J. Org. Chem., 67, 1333, 2002.To What Extent Can
Aromaticity Be Defined Uniquely?
- Ośmiałowski, B., Kolehmainen, E., Nissinen, M., Krygowski,
T. M., Gawinecki, R., J. Org. Chem., 67, 3339,
2002.(1Z,3Z)-1,4-Di(pyridin-2-yl)buta-1,3-diene-2,3-diol: The Planar
Highly Conjugated Symmetrical Enediol with Multiple Intramolecular
Hydrogen Bonds.
- Krygowski, T. M., Pindelska, E., Cyrański, M. K.,
Haefelinger, G., Chem. Phys. Lett. 359, 158 - 62, 2002, Planarization
of 1,3,5,7-cyclooctatetraene as a result of a partial rehybridization
at carbon atoms: an MP2/6-31G* and B3LYP/6-311G** study.
- Krygowski, T. M., Pindelska, E., Anulewicz - Ostrowska, R.,
Nowacki, J., Pol. J. Chem., 2002, 76, 1249 -54. Angular Group-Induced
Bond Alternation (AGIBA), Part VIII Crystal and Molecular Structure of
2,3,6,7-tetrahydro-1H,5H-pirydo[3,2,1-ij]quinoline-9-carbaldehyde(E,E)-azine.
A Competition Between the AGIBA and the Through Resonance Effects.
- Stępień, B. T., Krygowski, T. M. and Cyrański, M. K., J.
Org. Chem., 67, 5987 - 5992, 2002.How Far Can Cyclic -Electron
Delocalization Be Modified in Exocyclically Substituted Fulvenes?
- Krygowski T. M., Pindelska E., Cyrański M. K., Nowacki J.,
Int. Electr. J. Mol. Des., 1, 593 - 602, 2002, "Angular Group Induced
Bond Alternation (AGIBA) Part IX. Interactions with the Pirimidine
Ring".
- Bodwell G. J. , Bridson J. N., Cyrański M. K., Kennedy J.
W. J., Krygowski T. M., Mannion M. R., Miller D. O., Nonplanar Aromatic
Compounds. 8. Synthesis, Crystal Structures and Aromaticity
Investigations of the 1,n-Dioxa[n] (2,7) pyrenophanes. How does Bending
Affect the "Cyclic pi-electron Delocalization of the Pyrene System?" J.
Org. Chem, 68, 2089 - 2098, 2003.
- Stępień, B. T., Krygowski, T. M., Cyrański, M. K., J. Phys.
Org. Chem. 16, 426 - 430, 2003, "Variation of the -Electron
Delocalisation in Exocyclically Substituted Heptafulvene Derivatives"
- Jaworski, J.S., Krygowski T.M., Pol. J.Chem., 77. 221 -
225, 2003, Free Energy Contribution to the Specific Solvatation of
Anions. A Comparison of "Pure" Acidity Solvent Scales.
- Cyrański, M. K., Schleyer, P. v. R., Krygowski, T. M.,
Jiao, H., Hohlneicher, G., Tetrahedron, 59, 1657 - 65, 2003. Facts and
artifacts about aromatic stability estimation.
- Cyrański, M.K., Gilski, M., Jaskólski, M., Krygowski, T.
M., J. Org. Chem., 68, 8607 - 8613, 2003, On the Aromatic Character of
the Heterocyclic Bases of DNA and RNA.
- Krygowski, T.M., Cyrański, M.K., Phys.Chem. Chem. Phys., 6,
0000, 2003, Two faces of the structural aspects of aromaticity.
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