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Nicotinamide-2,2,2-trifluoroethanol (2/1)

Bardin, J. and Kennedy, A.R. and Wong, L.V. and Johnston, B.F. and Florence, A.J. (2009) Nicotinamide-2,2,2-trifluoroethanol (2/1). Acta Crystallographica Section E: Structure Reports, 65 (4). o727-o728. ISSN 1600-5368

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Abstract

The nicotinamide (NA) molecules of the title compound, 2C6H6N2O·C2H3F3O, form centrosymmetric R22(8) hydrogen-bonded dimers via N-HO contacts. The asymmetric unit contains two molecules of NA and one trifluoroethanol molecule disordered over two sites of equal occupancy. The packing consists of alternating layers of nicotinamide dimers and disordered 2,2,2-trifluoroethanol molecules stacking in the c-axis direction. Intramolecular C-HO and intermolecular N-HN, O-HN, C-HN, C-HO and C-HF interactions are present.

Item type: Article
ID code: 13007
Keywords: crystallography, nicotinamide dimers, pharmacology, trifluoroethanol molecules, Therapeutics. Pharmacology, Pharmacy and materia medica, Microbiology, Materials Science(all), Chemistry(all), Condensed Matter Physics
Subjects: Medicine > Therapeutics. Pharmacology
Medicine > Pharmacy and materia medica
Science > Microbiology
Department: Faculty of Science > Strathclyde Institute of Pharmacy and Biomedical Sciences
Faculty of Science > Pure and Applied Chemistry
Related URLs:
    Depositing user: Mr Scott Kilgariff
    Date Deposited: 02 Sep 2009 11:51
    Last modified: 28 Mar 2014 05:12
    URI: http://strathprints.strath.ac.uk/id/eprint/13007

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