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4-氯-N-(3-氯苯基)-2-甲基苯磺酰胺

4-Chloro-N-(3-chloro-phen-yl)-2-methyl-benzene-sulfonamide.

作者信息

Gowda B Thimme, Foro Sabine, Nirmala P G, Fuess Hartmut

出版信息

Acta Crystallogr Sect E Struct Rep Online. 2010 Jun 18;66(Pt 7):o1702. doi: 10.1107/S1600536810022968.

DOI:10.1107/S1600536810022968
PMID:21587922
原文链接:https://pmc.ncbi.nlm.nih.gov/articles/PMC3006774/
Abstract

In the title compound, C(13)H(11)Cl(2)NO(2)S, the conformation of the N-H bond in the C-SO(2)-NH-C segment is anti to the meta-Cl atom on the aniline ring and syn to the ortho-methyl group on the sulfonyl-benzene ring. Furthermore, the torsion angle of the C-SO(2)-NH-C segment in the mol-ecule is 80.1 (3)°. The two benzene rings are tilted relative to each other by 70.9 (1)°. In the crystal, pairs of inter-molecular N-H⋯O hydrogen bonds link the mol-ecules via inversion-related dimers into infinite column-like chains.

摘要

在标题化合物C(13)H(11)Cl(2)NO(2)S中,C-SO(2)-NH-C片段中N-H键的构象与苯胺环上的间位氯原子呈反式,与磺酰苯环上的邻位甲基呈顺式。此外,分子中C-SO(2)-NH-C片段的扭转角为80.1 (3)°。两个苯环彼此倾斜70.9 (1)°。在晶体中,分子间的N-H⋯O氢键对通过与反演相关的二聚体将分子连接成无限的柱状链。

https://cdn.ncbi.nlm.nih.gov/pmc/blobs/7a3f/3006774/6e3aa062c555/e-66-o1702-fig2.jpg
https://cdn.ncbi.nlm.nih.gov/pmc/blobs/7a3f/3006774/639a2f9539f0/e-66-o1702-fig1.jpg
https://cdn.ncbi.nlm.nih.gov/pmc/blobs/7a3f/3006774/6e3aa062c555/e-66-o1702-fig2.jpg
https://cdn.ncbi.nlm.nih.gov/pmc/blobs/7a3f/3006774/639a2f9539f0/e-66-o1702-fig1.jpg
https://cdn.ncbi.nlm.nih.gov/pmc/blobs/7a3f/3006774/6e3aa062c555/e-66-o1702-fig2.jpg

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