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1-甲基-3-三氟甲基-5-[(3-氯苯基)硫基]-1H-吡唑-4-甲醛 O-(4-氯苯甲酰基)肟

1-Methyl-3-trifluoro-methyl-5-[(3-chloro-phen-yl)sulfanyl]-1H-pyrazole-4-carbaldehyde O-(4-chloro-benzo-yl)oxime.

作者信息

Dai Hong, Zhang Hai-Jun, Shi Lei, Luo Kun-Peng, Shi Yu-Jun

机构信息

College of Chemistry and Chemical Engineering, Nantong University, Nantong 226019, Peoples' Republic of China.

出版信息

Acta Crystallogr Sect E Struct Rep Online. 2011 Dec 1;67(Pt 12):o3343. doi: 10.1107/S1600536811047970. Epub 2011 Nov 19.

DOI:10.1107/S1600536811047970
PMID:22199838
原文链接:https://pmc.ncbi.nlm.nih.gov/articles/PMC3238989/
Abstract

In the title compound, C(19)H(12)Cl(2)F(3)N(3)O(2)S, the 3-chloro-phenyl and 4-chloro-phenyl rings form dihedral angles 89.5 (2) and 11.4 (2)°, respectively, with the pyrazole ring. In the crystal, mol-ecules related by translation along the a axis are linked into chains via C-H⋯N hydrogen bonds.

摘要

在标题化合物C(19)H(12)Cl(2)F(3)N(3)O(2)S中，3-氯苯基和4-氯苯基环分别与吡唑环形成89.5 (2)°和11.4 (2)°的二面角。在晶体中，沿a轴平移相关的分子通过C-H⋯N氢键连接成链。

https://cdn.ncbi.nlm.nih.gov/pmc/blobs/f3ba/3238989/7482a49ca306/e-67-o3343-fig1.jpg
https://cdn.ncbi.nlm.nih.gov/pmc/blobs/f3ba/3238989/7482a49ca306/e-67-o3343-fig1.jpg
https://cdn.ncbi.nlm.nih.gov/pmc/blobs/f3ba/3238989/7482a49ca306/e-67-o3343-fig1.jpg

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本文引用的文献

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2
A short history of SHELX.SHELX简史。
Acta Crystallogr A. 2008 Jan;64(Pt 1):112-22. doi: 10.1107/S0108767307043930. Epub 2007 Dec 21.