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2,2'-二氨基-N,N'-(邻亚苯基)二苯甲酰胺

2,2'-Diamino-N,N'-(o-phenyl-ene)di-benz-amide.

作者信息

Booysen Irvin, Gerber Thomas I A, Hosten Eric, Mayer Peter

出版信息

Acta Crystallogr Sect E Struct Rep Online. 2009 Mar 25;65(Pt 4):o850. doi: 10.1107/S1600536809009283.

DOI:10.1107/S1600536809009283
PMID:21582568
原文链接:https://pmc.ncbi.nlm.nih.gov/articles/PMC2968993/
Abstract

In the structure of the title compound, C(20)H(18)N(4)O(2), the N-H and C=O bonds are trans to each other and the amide O atoms are syn to the ortho amino N atom in the benzoyl rings. The amide groups form dihedral angles of 8.4 (2) and 13.8 (2)° with their respective benzoyl rings, and dihedral angles of 51.85 (16) and 51.19 (17)° with the phenyl-enediamine ring. In the crystal, a centrosymmetric dimer is formed by inter-molecular N-H⋯O hydrogen bonds, resulting in an R(2) (2)(14) descriptor on a unitary level of graph-set analysis, and three intramolecular N-H⋯O bonds also occur.

摘要

在标题化合物C(20)H(18)N(4)O(2)的结构中,N-H键和C=O键彼此呈反式,且酰胺O原子与苯甲酰环中的邻氨基N原子呈顺式。酰胺基团与其各自的苯甲酰环形成的二面角为8.4 (2)°和13.8 (2)°,与苯二胺环形成的二面角为51.85 (16)°和51.19 (17)°。在晶体中,通过分子间N-H⋯O氢键形成了一个中心对称二聚体,在图形集分析的单一水平上得到R(2) (2)(14)描述符,并且还存在三个分子内N-H⋯O键。

https://cdn.ncbi.nlm.nih.gov/pmc/blobs/5dc4/2968993/2421c44d9e07/e-65-0o850-fig2.jpg
https://cdn.ncbi.nlm.nih.gov/pmc/blobs/5dc4/2968993/2db43a96d074/e-65-0o850-fig1.jpg
https://cdn.ncbi.nlm.nih.gov/pmc/blobs/5dc4/2968993/2421c44d9e07/e-65-0o850-fig2.jpg
https://cdn.ncbi.nlm.nih.gov/pmc/blobs/5dc4/2968993/2db43a96d074/e-65-0o850-fig1.jpg
https://cdn.ncbi.nlm.nih.gov/pmc/blobs/5dc4/2968993/2421c44d9e07/e-65-0o850-fig2.jpg

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