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N-苄基苯胺

N-Benzyl-aniline.

作者信息

Betz Richard, McCleland Cedric, Marchand Harold

机构信息

Nelson Mandela Metropolitan University, Summerstrand Campus, Department of Chemistry, University Way, Summerstrand, PO Box 77000, Port Elizabeth 6031, South Africa.

出版信息

Acta Crystallogr Sect E Struct Rep Online. 2011 May 1;67(Pt 5):o1195. doi: 10.1107/S1600536811014553. Epub 2011 Apr 22.

DOI:10.1107/S1600536811014553
PMID:21754497
原文链接:https://pmc.ncbi.nlm.nih.gov/articles/PMC3089167/
Abstract

The title compound, C(13)H(13)N, is an N-alkyl-ated derivative of aniline. The N atom is present in a nearly planar mol-ecular geometry (angles sums at the N atom are 358 and 359° in the two molecules of the asymmetric unit). The planes defined by the aromatic rings intersect at angles of 80.76 (4) and 81.40 (4)° in the two molecules. In the crystal, N-H⋯Cg inter-actions connect the two mol-ecules of the asymmetric unit to form infinite homodromic chains along the crystallographic b axis [N⋯π = 3.4782 (12) and 3.4642 (13) Å].

摘要

标题化合物C₁₃H₁₃N是苯胺的N-烷基化衍生物。N原子处于近乎平面的分子几何构型中(不对称单元的两个分子中N原子处的角度总和分别为358°和359°)。两个分子中由芳环定义的平面以80.76(4)°和81.40(4)°的角度相交。在晶体中,N-H⋯Cg相互作用将不对称单元的两个分子连接起来,沿着结晶学b轴形成无限的同向链[N⋯π = 3.4782(12)和3.4642(13) Å]。

https://cdn.ncbi.nlm.nih.gov/pmc/blobs/3fa4/3089167/794176f9af34/e-67-o1195-fig3.jpg
https://cdn.ncbi.nlm.nih.gov/pmc/blobs/3fa4/3089167/2d0e130740fe/e-67-o1195-fig1.jpg
https://cdn.ncbi.nlm.nih.gov/pmc/blobs/3fa4/3089167/9551ce9088bf/e-67-o1195-fig2.jpg
https://cdn.ncbi.nlm.nih.gov/pmc/blobs/3fa4/3089167/794176f9af34/e-67-o1195-fig3.jpg
https://cdn.ncbi.nlm.nih.gov/pmc/blobs/3fa4/3089167/2d0e130740fe/e-67-o1195-fig1.jpg
https://cdn.ncbi.nlm.nih.gov/pmc/blobs/3fa4/3089167/9551ce9088bf/e-67-o1195-fig2.jpg
https://cdn.ncbi.nlm.nih.gov/pmc/blobs/3fa4/3089167/794176f9af34/e-67-o1195-fig3.jpg

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