5-溴-2-甲基-3-(3-甲基苯基亚磺酰基)-1-苯并呋喃
5-Bromo-2-methyl-3-(3-methyl-phenyl-sulfin-yl)-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.
Department of Chemistry, Pukyong National University, 599-1 Daeyeon 3-dong, Nam-gu, Busan 608-737, Republic of Korea.
出版信息
Acta Crystallogr Sect E Struct Rep Online. 2014 Feb 19;70(Pt 3):o320. doi: 10.1107/S1600536814003365. eCollection 2014 Mar 1.
In the title compound, C16H13BrO2S, the dihedral angle between the mean plane [r.m.s. deviation = 0.012 (1) Å] of the benzo-furan ring system and the 3-methyl-phenyl ring is 84.83 (4)°. In the crystal, mol-ecules are linked via pairs of Br⋯O [3.240 (1) Å] contacts, forming inversion dimers. These dimers are linked by C-H⋯π inter-actions, forming a three-dimensional network.
在标题化合物C₁₆H₁₃BrO₂S中，苯并呋喃环系的平均平面（均方根偏差 = 0.012 (1) Å）与3-甲基苯基环之间的二面角为84.83 (4)°。在晶体中，分子通过Br⋯O对[3.240 (1) Å]接触相连，形成反演二聚体。这些二聚体通过C-H⋯π相互作用相连，形成三维网络。
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