Structure of 6-hydroxy-1-methylquinolinium chloride hydrate studied by X-ray, DFT calculations, FTIR and NMR spectroscopes
Barczyński, P., Komasa, A., Ratajczak-Sitarz, M., Katrusiak, A., Koput, J., Dega-Szafran, Z., Szafran, M.
Published in Journal of molecular structure (15.12.2010)
Published in Journal of molecular structure (15.12.2010)
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Conformational analysis of bis(trigonelline) hydrochloride, perchlorate and their monohydrates by the B3LYP calculations, X-ray diffraction and vibrational spectra
Szafran, M., Katrusiak, A., Koput, J., Dega-Szafran, Z.
Published in Journal of molecular structure (20.02.2006)
Published in Journal of molecular structure (20.02.2006)
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Journal Article
HCP<=>CPH isomerization: caught in the act
Ishikawa, H, Field, R W, Farantos, S C, Joyeux, M, Koput, J, Beck, C, Schinke, R
Published in Annual review of physical chemistry (01.01.1999)
Published in Annual review of physical chemistry (01.01.1999)
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X-ray and DFT studies of the structure, vibrational and NMR spectra of 2-amino-pyridine betaine hydrochloride
Szafran, M., Kowalczyk, I., Koput, J., Katrusiak, A.
Published in Journal of molecular structure (03.06.2005)
Published in Journal of molecular structure (03.06.2005)
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Orientations of water molecule and hydronium ion in 1-methylquinolinium-3-carboxy chloride monohydrate studied by X-ray diffraction, DFT calculations, NMR, FTIR and Raman spectra
Barczyński, P., Katrusiak, A., Koput, J., Dega-Szafran, Z., Szafran, M.
Published in Journal of molecular structure (29.01.2009)
Published in Journal of molecular structure (29.01.2009)
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Journal Article
X-Ray, MP2 and DFT studies of the structure and vibrational spectra of homarinium chloride
Szafran, M., Koput, J., Dega-Szafran, Z., Katrusiak, A.
Published in Journal of molecular structure (20.08.2004)
Published in Journal of molecular structure (20.08.2004)
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Journal Article
X-ray, MP2 and DFT studies of the structure and vibrational spectra of trigonellinium chloride
Szafran, M., Koput, J., Dega-Szafran, Z., Katrusiak, A., Pankowski, M., Stobiecka, K.
Published in Chemical physics (15.04.2003)
Published in Chemical physics (15.04.2003)
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Ab initio and DFT calculations of the structure and vibrational spectra of trigonelline
Szafran, M, Koput, J, Dega-Szafran, Z, Pankowski, M
Published in Journal of molecular structure (02.09.2002)
Published in Journal of molecular structure (02.09.2002)
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Novel Chiral Pyromellitdiimide (1,2,4,5-Benzenetetracarboxydiimide) Dimers and Trimers: Exploring Their Structure, Electronic Transitions, and Exciton Coupling
Gawroński, Jacek, Brzostowska, Małgorzata, Gawrońska, Krystyna, Koput, Jacek, Rychlewska, Urszula, Skowronek, Paweł, Nordén, Bengt
Published in Chemistry : a European journal (03.06.2002)
Published in Chemistry : a European journal (03.06.2002)
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Unimolecular dissociation of HOCl: unexpectedly broad distribution of rate constants
Hauschildt, J., Weiß, J., Beck, C., Grebenshchikov, S.Yu, Düren, R., Schinke, Reinhard, Koput, J.
Published in Chemical physics letters (12.02.1999)
Published in Chemical physics letters (12.02.1999)
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