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2-(4-氟-2-硝基苯基)-4-羟基-9-苯基磺酰基-9H-咔唑-3-甲醛

2-(4-Fluoro-2-nitro-phen-yl)-4-hy-droxy-9-phenyl-sulfonyl-9H-carbazole-3-carbaldehyde.

作者信息

Gopinath S, Sethusankar K, Saravanan Velu, Mohanakrishnan Arasambattu K

机构信息

Department of Physics, RKM Vivekananda College (Autonomous), Chennai 600 004, India.

Department of Organic Chemistry, University of Madras, Maraimalai Campus, Chennai 600 025, India.

出版信息

Acta Crystallogr Sect E Struct Rep Online. 2014 Feb 12;70(Pt 3):o273-4. doi: 10.1107/S1600536814002633. eCollection 2014 Mar 1.

Abstract

In the title compound, C25H15FN2O6S, the carbazole ring system is essentially planar, with a maximum deviation of 0.1534 (16) Å for the C atom connected to the 4-fluoro-2-nitro-phenyl ring. It is almost orthogonal to the phenyl-sulfonyl and nitro-phenyl rings, making dihedral angles of 88.45 (8) and 79.26 (7)°, respectively. The mol-ecular structure is stabilized by O-H⋯O and C-H⋯O hydrogen bonds, which generate three S(6) ring motifs. In the crystal, mol-ecules are linked by two C-H⋯O hydrogen bonds, which generate C(6) and C(9) chains running in the [100] and [010] directions, respectively, so forming a two-dimensional network lying parallel to (001). There are also supra-molecular R 4 (3)(28) graph-set ring motifs enclosed within these networks.

摘要

在标题化合物C₂₅H₁₅FN₂O₆S中,咔唑环系基本呈平面状,与连接4-氟-2-硝基苯环的C原子的最大偏差为0.1534 (16) Å。它几乎与苯磺酰基环和硝基苯环正交,二面角分别为88.45 (8)°和79.26 (7)°。分子结构通过O—H⋯O和C—H⋯O氢键得以稳定,形成了三个S(6)环模式。在晶体中,分子通过两个C—H⋯O氢键相连,分别形成沿[100]和[010]方向延伸的C(6)和C(9)链,从而形成平行于(001)的二维网络。这些网络中还包含超分子R 4 (3)(28)图集环模式。

https://cdn.ncbi.nlm.nih.gov/pmc/blobs/e98f/3998398/f9a981ceeb88/e-70-0o273-fig1.jpg

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