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2-氯-N-(4-甲氧基苯甲酰基)苯磺酰胺

2-Chloro-N-(4-meth-oxy-benzo-yl)-benzene-sulfonamide.

作者信息

Sreenivasa S, Palakshamurthy B S, Pampa K J, Lokanath N K, Suchetan P A

机构信息

Department of Studies and Research in Chemistry, Tumkur University, Tumkur, Karnataka 572 103, India.

Department of Studies and Research in Physics, U.C.S., Tumkur University, Tumkur, Karnataka 572 103, India.

出版信息

Acta Crystallogr Sect E Struct Rep Online. 2014 Jan 25;70(Pt 2):o199. doi: 10.1107/S1600536814001482. eCollection 2014 Feb 1.

DOI:10.1107/S1600536814001482
PMID:24764909
原文链接:https://pmc.ncbi.nlm.nih.gov/articles/PMC3998348/
Abstract

In the title compound, C14H12ClNO4S, the dihedral angle between the aromatic rings is 82.07 (1)° and the dihedral angle between the planes defined by the S-N-C=O fragment and the sulfonyl benzene ring is 82.46 (3)°. In the crystal, the mol-ecules are linked into C(4) chains running along [001] by strong N-H⋯O hydrogen bonds. A C-H⋯O intera-ction reinforces the [001] chains: its graph-set symbol is C(7). The chains are cross-linked into (100) sheets by further C-H⋯O inter-actions as C(6) chains along [001]. The structure also features weak π-π stacking inter-actions [centroid-centroid distances = 3.577 (1) and 3.8016 (1) Å].

摘要

在标题化合物C₁₄H₁₂ClNO₄S中,芳环之间的二面角为82.07 (1)°,由S-N-C=O片段和磺酰苯环所定义平面之间的二面角为82.46 (3)°。在晶体中,分子通过强N-H⋯O氢键连接成沿[001]方向延伸的C(4)链。一个C-H⋯O相互作用加强了[001]链:其图形集符号为C(7)。这些链通过沿[001]方向作为C(6)链的进一步C-H⋯O相互作用交联成(100)片层。该结构还具有弱的π-π堆积相互作用[质心-质心距离 = 3.577 (1) 和3.8016 (1) Å]。

https://cdn.ncbi.nlm.nih.gov/pmc/blobs/2fe7/3998348/3ddb1fc9227f/e-70-0o199-fig5.jpg
https://cdn.ncbi.nlm.nih.gov/pmc/blobs/2fe7/3998348/d216583586b6/e-70-0o199-fig1.jpg
https://cdn.ncbi.nlm.nih.gov/pmc/blobs/2fe7/3998348/c97217a900c4/e-70-0o199-fig2.jpg
https://cdn.ncbi.nlm.nih.gov/pmc/blobs/2fe7/3998348/9c9e944b5e8e/e-70-0o199-fig3.jpg
https://cdn.ncbi.nlm.nih.gov/pmc/blobs/2fe7/3998348/61dcb1108f77/e-70-0o199-fig4.jpg
https://cdn.ncbi.nlm.nih.gov/pmc/blobs/2fe7/3998348/3ddb1fc9227f/e-70-0o199-fig5.jpg
https://cdn.ncbi.nlm.nih.gov/pmc/blobs/2fe7/3998348/d216583586b6/e-70-0o199-fig1.jpg
https://cdn.ncbi.nlm.nih.gov/pmc/blobs/2fe7/3998348/c97217a900c4/e-70-0o199-fig2.jpg
https://cdn.ncbi.nlm.nih.gov/pmc/blobs/2fe7/3998348/9c9e944b5e8e/e-70-0o199-fig3.jpg
https://cdn.ncbi.nlm.nih.gov/pmc/blobs/2fe7/3998348/61dcb1108f77/e-70-0o199-fig4.jpg
https://cdn.ncbi.nlm.nih.gov/pmc/blobs/2fe7/3998348/3ddb1fc9227f/e-70-0o199-fig5.jpg

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