2-[2-苯基-1-(苯基磺酰基)乙基]-1-苯基磺酰基-1H-吲哚的晶体结构
Crystal structure of 2-[2-phenyl-1-(phenyl-sulfon-yl)eth-yl]-1-phenyl-sulfonyl-1H-indole.
作者信息
Umadevi M, Raju Potharaju, Yamuna R, Mohanakrishnan Arasambattu K, Chakkaravarthi G
机构信息
Research and Development Centre, Bharathiyar University, Coimbatore 641 046, India; Department of Chemistry, Pallavan College of Engineering, Kanchipuram 631 502, India.
Department of Organic Chemistry, University of Madras, Guindy Campus, Chennai 600 025, India.
出版信息
Acta Crystallogr E Crystallogr Commun. 2015 Nov 4;71(Pt 12):o910-1. doi: 10.1107/S2056989015019428. eCollection 2015 Dec 1.
In the title compound, C28H23NO4S2, the indole ring system (r.m.s. deviation = 0.007 Å) subtends dihedral angles of 78.69 (13) and 38.97 (13)° with the planes of the N- and C-bonded sulfonyl-benzene rings, respectively, and these two benzene rings are inclined to each other at an angle of 65.45 (16)°. The methyl-ene-linked phenyl ring is twisted at an angle of 81.80 (13)° from the indole ring. The mol-ecular structure features two short intra-molecular C-H⋯O contacts, which both generate S(6) rings. In the crystal, mol-ecules are linked by C-H⋯O hydrogen bonds and C-H⋯π inter-actions, generating a three-dimensional network.
在标题化合物C₂₈H₂₃NO₄S₂中，吲哚环系统（均方根偏差 = 0.007 Å）与N键合和C键合的磺酰基苯环平面分别呈78.69（13）°和38.97（13）°的二面角，且这两个苯环相互倾斜65.45（16）°。亚甲基连接的苯环与吲哚环扭转81.80（13）°。分子结构具有两个短的分子内C-H⋯O接触，二者均形成S(6)环。在晶体中，分子通过C-H⋯O氢键和C-H⋯π相互作用相连，形成三维网络。
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