Crystal structure of 5-chloro-2,4,6-trimethyl-3-(4-methyl-phenyl-sulfin-yl)-1-benzo-furan.

IF 0.9

Acta crystallographica. Section E, Structure reports online Pub Date : 2014-11-05 eCollection Date: 2014-12-01 DOI:10.1107/S160053681402385X

Hong Dae Choi, Uk Lee

引用次数: 0

Abstract

In the title compound, C18H17ClO2S, the dihedral angle between the planes of the benzo-furan ring [r.m.s. deviation = 0.013 (1) Å] and the 4-methyl-phenyl ring is 87.37 (5)°. In the crystal, mol-ecules are linked by C-H⋯O hydrogen bonds and π-π inter-actions between the furan and benzene rings of neighbouring mol-ecules [centroid-centroid distance = 3.525 (2) Å]. In addition, an S⋯S [3.6584 (9) Å] contact is observed.

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5-氯-2,4,6-三甲基-3-(4-甲基苯基亚砜基)-1-苯并呋喃的晶体结构。

在标题化合物C18H17ClO2S中，苯并呋喃环平面间的二面角[r.m.s。偏差= 0.013 (1)Å]， 4-甲基苯基环为87.37(5)°。在晶体中，分子-分子通过C-H⋯O氢键和相邻分子的呋喃和苯环之间的π-π相互作用连接[质心-质心距离= 3.525 (2)Å]。此外，还观察到S⋯S [3.6584 (9) Å]接触。

本文章由计算机程序翻译，如有差异，请以英文原文为准。

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来源期刊

Acta crystallographica. Section E, Structure reports online 化学-晶体学

自引率

33.30%

发文量

审稿时长

1.3 months

期刊介绍： Acta Crystallographica Section E: Structure Reports Online is the IUCr highly popular open-access structural journal. It provides a simple and easily accessible publication mechanism for the growing number of inorganic, metal-organic and organic crystal structure determinations. The electronic submission, validation, refereeing and publication facilities of the journal ensure very rapid and high-quality publication, whilst key indicators and validation reports provide measures of structural reliability. In 2009, the journal published over 4000 structures. The average publication time is less than one month.