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N-(2,6-二甲基苯基)-4-甲基苯甲酰胺

N-(2,6-Dimethyl-phen-yl)-4-methyl-benzamide.

作者信息

Gowda B Thimme, Tokarčík Miroslav, Kožíšek Jozef, Sowmya B P, Fuess Hartmut

出版信息

Acta Crystallogr Sect E Struct Rep Online. 2009 Jun 17;65(Pt 7):o1612. doi: 10.1107/S1600536809022648.

DOI:10.1107/S1600536809022648
PMID:21582884
原文链接:https://pmc.ncbi.nlm.nih.gov/articles/PMC2969511/
Abstract

In the mol-ecular structure of the title compound, C(16)H(17)NO, the two aromatic rings are close to orthogonal to each other [dihedral angle 78.8 (1)°], while the central -NH-C(=O)- amide core is nearly coplanar with the benzoyl ring, forming a dihedral angle of 3.5 (2)°. Inter-molecular N-H⋯O hydrogen bonds in the crystal structure link the mol-ecules into infinite chains running along the c axis of the crystal, and a C-H⋯O interaction also occurs.

摘要

在标题化合物C(16)H(17)NO的分子结构中,两个芳环彼此接近正交[二面角78.8 (1)°],而中心的-NH-C(=O)-酰胺核心与苯甲酰环几乎共面,形成二面角3.5 (2)°。晶体结构中的分子间N-H⋯O氢键将分子连接成沿晶体c轴延伸的无限链,并且还存在C-H⋯O相互作用。

https://cdn.ncbi.nlm.nih.gov/pmc/blobs/1287/2969511/8553cc559f18/e-65-o1612-fig2.jpg
https://cdn.ncbi.nlm.nih.gov/pmc/blobs/1287/2969511/66140a5f581e/e-65-o1612-fig1.jpg
https://cdn.ncbi.nlm.nih.gov/pmc/blobs/1287/2969511/8553cc559f18/e-65-o1612-fig2.jpg
https://cdn.ncbi.nlm.nih.gov/pmc/blobs/1287/2969511/66140a5f581e/e-65-o1612-fig1.jpg
https://cdn.ncbi.nlm.nih.gov/pmc/blobs/1287/2969511/8553cc559f18/e-65-o1612-fig2.jpg

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