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3-（4-溴-苯基亚磺酰基）-2,5,6-三甲基-1-苯并呋喃

3-(4-Bromo-phenyl-sulfin-yl)-2,5,6-trimethyl-1-benzo-furan.

作者信息

Choi Hong Dae, Seo Pil Ja, Lee Uk

机构信息

Department of Chemistry, Dongeui University, San 24 Kaya-dong, Busanjin-gu, Busan 614-714, Republic of Korea.

出版信息

Acta Crystallogr Sect E Struct Rep Online. 2013 Jul 6;69(Pt 8):o1205. doi: 10.1107/S1600536813017753. eCollection 2013.

DOI:10.1107/S1600536813017753
PMID:24109302
原文链接:https://pmc.ncbi.nlm.nih.gov/articles/PMC3793715/
Abstract

In the title compound, C17H15BrO2S, the dihedral angle between the mean plane [r.m.s. deviation = 0.003 (2) Å] of the benzo-furan ring system and the mean plane [r.m.s. deviation = 0.006 (2) Å] of the 4-bromo-phenyl ring is 83.09 (7)°. In the crystal, weak C-H⋯π inter-actions are observed.

摘要

在标题化合物C₁₇H₁₅BrO₂S中，苯并呋喃环系的平均平面[r.m.s.偏差 = 0.003 (2) Å]与4-溴苯基环的平均平面[r.m.s.偏差 = 0.006 (2) Å]之间的二面角为83.09 (7)°。在晶体中，观察到弱的C-H⋯π相互作用。

https://cdn.ncbi.nlm.nih.gov/pmc/blobs/89af/3793715/a25fcd342d47/e-69-o1205-fig2.jpg
https://cdn.ncbi.nlm.nih.gov/pmc/blobs/89af/3793715/c8f6a68aec3b/e-69-o1205-fig1.jpg
https://cdn.ncbi.nlm.nih.gov/pmc/blobs/89af/3793715/a25fcd342d47/e-69-o1205-fig2.jpg
https://cdn.ncbi.nlm.nih.gov/pmc/blobs/89af/3793715/c8f6a68aec3b/e-69-o1205-fig1.jpg
https://cdn.ncbi.nlm.nih.gov/pmc/blobs/89af/3793715/a25fcd342d47/e-69-o1205-fig2.jpg

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本文引用的文献

1
3-(4-Bromo-phenyl-sulfin-yl)-2,5-dimethyl-1-benzofuran.3-（4-溴-苯基亚磺酰基）-2,5-二甲基-1-苯并呋喃
Acta Crystallogr Sect E Struct Rep Online. 2012 Mar 1;68(Pt 3):o584. doi: 10.1107/S1600536812002656. Epub 2012 Feb 4.
2
3-(4-Chloro-phenyl-sulfin-yl)-2,5-dimethyl-1-benzofuran.3-（4-氯-苯基亚磺酰基）-2,5-二甲基-1-苯并呋喃
Acta Crystallogr Sect E Struct Rep Online. 2010 Sep 11;66(Pt 10):o2551. doi: 10.1107/S1600536810035932.
3
3-(4-Fluoro-phenyl-sulfin-yl)-2,5-dimethyl-1-benzofuran.3-（4-氟-苯基亚磺酰基）-2,5-二甲基-1-苯并呋喃
Acta Crystallogr Sect E Struct Rep Online. 2010 Feb 6;66(Pt 3):o543. doi: 10.1107/S1600536810003740.
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A short history of SHELX.SHELX简史。
Acta Crystallogr A. 2008 Jan;64(Pt 1):112-22. doi: 10.1107/S0108767307043930. Epub 2007 Dec 21.