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4-(1H-Pyrazol-3-yl)pyridine-terephthalic acid-water (2/1/2).

作者信息

Tan Zheng-De, Tan Feng-Jiao, Tan Bo, Zhang Cheng-Ming

出版信息

Acta Crystallogr Sect E Struct Rep Online. 2012 Jun 1;68(Pt 6):o1942. doi: 10.1107/S1600536812021599. Epub 2012 May 31.

Abstract

In the title compound, 2C(8)H(7)N(3)·C(8)H(6)O(4)·2H(2)O, the pyridine and pyrazole rings are approximately coplanar, the dihedral angle between them being 4.69 (9)°. The asymmetric unit consists of half of the terephthalic acid (an inversion centre generates the other half of the mol-ecule), one 4-(1H-pyrazol-3-yl)pyridine (4pp) mol-ecule and one water mol-ecule. In the crystal, two 4pp and one terephthalic acid mol-ecules form a linear three-molecule unit as a result of O-H⋯N hydrogen bonds. These units are further assembled into a three-dimensional network by two types of hydrogen bonds, viz. O-H⋯O and N-H⋯O.

摘要
https://cdn.ncbi.nlm.nih.gov/pmc/blobs/3e60/3379495/3cc898f6c662/e-68-o1942-fig1.jpg

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