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9 -(4 - 甲氧基 - 苯基)- 9 - 咔唑

9-(4-Meth-oxy-phen-yl)-9-carbazole.

作者信息

Ganesan Prabhu, Jasmine Nithianantham Jeeva, Darious Robert Swinton, Soundararajan Krishnan, Rajalingam Renganathan

机构信息

School of Chemistry, Bharathidasan University, Tiruchirappalli-620 024, Tamil Nadu, India.

Molecular Biophysics Unit, Indian Institute of Science, Bangalore, India.

出版信息

IUCrdata. 2023 Aug 10;8(Pt 8):x230674. doi: 10.1107/S2414314623006740. eCollection 2023 Aug.

Abstract

In the title compound, CHNO, the dihedral angle between the benzene rings of the carbazole moiety is 1.73 (12)° and the meth-oxy-substituted phenyl ring deviates from the mean plane of the carbazole grouping (r.m.s. deviation = 0.020 Å) by 56.78 (8)°. In the crystal, weak C-H⋯π inter-actions link the mol-ecules. The two-dimensional fingerprint plots derived from the Hirshfeld surface indicate that H⋯H (51.2%) and C⋯H/H⋯C (39.9%) contacts dominate the packing.

摘要

在标题化合物CHNO中,咔唑部分的苯环之间的二面角为1.73 (12)°,甲氧基取代的苯环偏离咔唑基团的平均平面(均方根偏差 = 0.020 Å)56.78 (8)°。在晶体中,弱的C-H⋯π相互作用连接分子。从 Hirshfeld 表面导出的二维指纹图谱表明,H⋯H(51.2%)和C⋯H/H⋯C(39.9%)接触主导堆积。

https://cdn.ncbi.nlm.nih.gov/pmc/blobs/530a/10483533/9cb5f76b065a/x-08-x230674-fig1.jpg

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