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3-[4-(2-氯-亚苄基氨基)-3-甲基-5-硫亚基-4,5-二氢-1H-1,2,4-三唑-1-基]-1,3-二苯基-丙-1-酮

3-[4-(2-Chloro-benzyl-idene-amino)-3-methyl-5-sulfanyl-idene-4,5-dihydro-1H-1,2,4-triazol-1-yl]-1,3-diphenyl-propan-1-one.

作者信息

Wang Wei, Liu Qing-Lei, Gao Yan, Wu Wen-Peng, Xu Chao

出版信息

Acta Crystallogr Sect E Struct Rep Online. 2011 Sep 1;67(Pt 9):o2379. doi: 10.1107/S1600536811032983. Epub 2011 Aug 27.

DOI:10.1107/S1600536811032983
PMID:22064665
原文链接:https://pmc.ncbi.nlm.nih.gov/articles/PMC3200689/
Abstract

In the title mol-ecule, C(25)H(21)ClN(4)OS, the triazole ring forms dihedral angles of 47.9 (2), 84.5 (2) and 3.9 (2)° with the two phenyl rings and the chloro-phenyl ring, respectively. The chloro-phenyl ring, the triazole ring and the conjugative linker between the two aromatic rings are nearly coplanar with an r.m.s. deviation of 0.0483 (2) Å and a maximum deviation of 0.0911 (2) Å.

摘要

在标题分子C(25)H(21)ClN(4)OS中，三唑环与两个苯环和氯苯环分别形成的二面角为47.9 (2)°、84.5 (2)°和3.9 (2)°。氯苯环、三唑环以及两个芳香环之间的共轭连接体几乎共面，均方根偏差为0.0483 (2) Å，最大偏差为0.0911 (2) Å。

https://cdn.ncbi.nlm.nih.gov/pmc/blobs/46a8/3200689/6526a987ea6f/e-67-o2379-fig1.jpg
https://cdn.ncbi.nlm.nih.gov/pmc/blobs/46a8/3200689/6526a987ea6f/e-67-o2379-fig1.jpg
https://cdn.ncbi.nlm.nih.gov/pmc/blobs/46a8/3200689/6526a987ea6f/e-67-o2379-fig1.jpg

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本文引用的文献

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4,4',5,5'-Tetra-phenyl-3,3'-[methyl-idene-bis(sulfanedi-yl)]bis-(4H-1,2,4-triazole).4,4',5,5'-四苯基-3,3'-[亚甲基双(硫烷二基)]双-(4H-1,2,4-三唑)
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