kax_hpc – Page 29 – Department of Materials Chemistry

1 September 2006

X-ray and ab initio studies of the structure and vibrational spectra of 4-carboxy-1-methylpyridinium chloride

X-ray and ab initio studies of the structure and vibrational spectra of 4-carboxy-1-methylpyridinium chloride

Journal of Molecular Structure

Mirosław Szafran, Jacek Koput, Zofia Dega-Szafran, Andrzej Katrusiak

1 September 2006

Structure and properties of the 1:2 complex of 1,4-dicarboxymethyl-1,4-dimethylpiperazinium inner salt (di-betaine) with p-hydroxybenzoic acid studied by X-ray, DFT, FTIR and NMR methods

Structure and properties of the 1:2 complex of 1,4-dicarboxymethyl-1,4-dimethylpiperazinium inner salt (di-betaine) with p-hydroxybenzoic acid studied by X-ray, DFT, FTIR and NMR methods

Journal of Molecular Structure

Z. Dega-Szafran, A. Katrusiak, M. Szafran

Hydrogen bonds and conformational analysis of bis(1-methylisonicotinate) hydrochloride monohydrate by X-ray diffraction, vibrational spectra and B3LYP calculations

Hydrogen bonds and conformational analysis of bis(1-methylisonicotinate) hydrochloride monohydrate by X-ray diffraction, vibrational spectra and B3LYP calculations

Journal of Molecular Structure

Mirosław Szafran, Andrzej Katrusiak, Zofia Dega-Szafran

Structure of 3-hydroxy-3-phenyl-pyrido[2,1-c][1,4]dihydrooxazinium bromide studied by X-ray, FTIR, 1H, 13C and 15N NMR, and DFT methods

Structure of 3-hydroxy-3-phenyl-pyrido[2,1-c][1,4]dihydrooxazinium bromide studied by X-ray, FTIR, 1H, 13C and 15N NMR, and DFT methods

Journal of Molecular Structure

Mirosław Szafran, Barbara Nowak-Wydra, Andrzej Katrusiak, Zofia Dega-Szafran

Molecular structure of 8-hydroxy-1-methylquinolinium iodide hydrate in crystal and solution

Molecular structure of 8-hydroxy-1-methylquinolinium iodide hydrate in crystal and solution

Journal of Molecular Structure

Piotr Barczyński, Anna Komasa, Małgorzata Ratajczak-Sitarz, Andrzej Katrusiak, Bogumil Brzezinski

Pressure Tuning between NH···N Hydrogen-Bonded Ice Analogue and NH···Br Polar dabcoHBr Complexes

Pressure Tuning between NH···N Hydrogen-Bonded Ice Analogue and NH···Br Polar dabcoHBr Complexes

The Journal of Physical Chemistry B

Armand Budzianowski, Andrzej Katrusiak

Effect of halogen atom exchange on the thermodynamic behavior and ferroelectric properties of[C(NH2)3]4Br2SO4

Effect of halogen atom exchange on the thermodynamic behavior and ferroelectric properties of[C(NH₂)₃]₄Br₂SO₄

Physical Review B

Marek Szafrański, Andrzej Katrusiak

X-ray, NMR and DFT studies of the complex of 1,4-dimethylpiperazine mono-betaine with p-hydroxybenzoic acid

X-ray, NMR and DFT studies of the complex of 1,4-dimethylpiperazine mono-betaine with p-hydroxybenzoic acid

Journal of Molecular Structure

Zofia Dega-Szafran, Andrzej Katrusiak, Mirosław Szafran

Crystal and molecular structure of 3-(2-amino-pyridinium)-propionate monohydrate

Crystal and molecular structure of 3-(2-amino-pyridinium)-propionate monohydrate

Journal of Molecular Structure

Mirosław Szafran, Iwona Kowalczyk, Andrzej Katrusiak

24 February 2006

6-Chloro-3-chloromethylene-7-methyl-1,2,4-triazolo[4,3-b]pyridazine

6-Chloro-3-chloromethylene-7-methyl-1,2,4-triazolo[4,3-b]pyridazine

Acta Crystallographica Section E

Anna Katrusiak, Andrzej Katrusiak