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N-（3-氯-4-乙氧基苯甲酰基）-N'-（2-甲氧基苯基）硫脲

N-(3-Chloro-4-eth-oxy-benzo-yl)-N'-(2-meth-oxy-phen-yl)thio-urea.

作者信息

Hu Jing-Han, Luo Zhong-Yi, Ding Chen-Fei, Song Xiao-Li

机构信息

College of Chemical and Biological Engineering, Lanzhou Jiaotong University, Lanzhou 730070, People's Republic of China.

出版信息

Acta Crystallogr Sect E Struct Rep Online. 2011 Jan 12;67(Pt 2):o376. doi: 10.1107/S1600536810054644.

DOI:10.1107/S1600536810054644
PMID:21523053
原文链接:https://pmc.ncbi.nlm.nih.gov/articles/PMC3051694/
Abstract

In the title compound, C(17)H(17)ClN(2)O(3)S, the central carbonyl-thio-urea unit is nearly planar [maximum atomic deviation = 0.019 (3) Å] and makes dihedral angles of 2.47 (7) and 17.76 (6)° with the terminal benzene rings. An intra-molecular N-H⋯O hydrogen bond occurs. Weak inter-molecular C-H⋯S and C-H⋯Cl hydrogen bonding is observed in the crystal structure.

摘要

在标题化合物C(17)H(17)ClN(2)O(3)S中，中心羰基 - 硫脲单元近乎平面 [最大原子偏差 = 0.019 (3) Å]，并与末端苯环形成2.47 (7)°和17.76 (6)°的二面角。存在分子内N - H⋯O氢键。在晶体结构中观察到弱的分子间C - H⋯S和C - H⋯Cl氢键。

https://cdn.ncbi.nlm.nih.gov/pmc/blobs/5637/3051694/502d16c8fd48/e-67-0o376-fig1.jpg
https://cdn.ncbi.nlm.nih.gov/pmc/blobs/5637/3051694/502d16c8fd48/e-67-0o376-fig1.jpg
https://cdn.ncbi.nlm.nih.gov/pmc/blobs/5637/3051694/502d16c8fd48/e-67-0o376-fig1.jpg

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