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A triclinic polymorph of 4-cyano-pyridinium hydrogen chloranilate.

作者信息

Gotoh Kazuma, Ishida Hiroyuki

机构信息

Department of Chemistry, Faculty of Science, Okayama University, Okayama 700-8530, Japan.

出版信息

Acta Crystallogr Sect E Struct Rep Online. 2012 Oct 1;68(Pt 10):o2830. doi: 10.1107/S1600536812037221. Epub 2012 Sep 1.

Abstract

THE ASYMMETRIC UNIT OF THE TRICLINIC POLYMORPH OF THE TITLE COMPOUND (SYSTEMATIC NAME: 4-cyano-pyridinium 2,5-dichloro-4-hy-droxy-3,6-dioxocyclo-hexa-1,4-dien-1-olate), C(6)H(5)N(2) (+)·C(6)HCl(2)O(4) (-), consists of two crystallographically independent cation-anion units, in each of which the cation and the anion are linked by an N-H⋯O hydrogen bond. In the units, the dihedral angles between the cation and anion rings are 78.43 (11) and 80.71 (11)°. In the crystal, each unit independently forms a chain through N-H⋯O and O-H⋯N hydrogen bonds; one chain runs along the c axis while the other runs along [011]. Weak C-H⋯O, C-H⋯N and C-H⋯Cl inter-actions are observed between the chains.

摘要
https://cdn.ncbi.nlm.nih.gov/pmc/blobs/7a79/3470192/d0b4b78a6311/e-68-o2830-fig1.jpg

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