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苯基 N-(4-甲氧基苯基)氨基甲酸酯

Phenyl N-(4-methoxy-phen-yl)carbamate.

作者信息

Fang Zheng, Wang Yong-Lu, Ren Li-Li, Wei Ping

出版信息

Acta Crystallogr Sect E Struct Rep Online. 2009 Jul 25;65(Pt 8):o1997. doi: 10.1107/S1600536809028785.

DOI:10.1107/S1600536809028785
PMID:21583669
原文链接:https://pmc.ncbi.nlm.nih.gov/articles/PMC2977260/
Abstract

The asymmetric unit of the title compound, C(14)H(13)NO(3), contains two crystallographically independent mol-ecules, in which the aromatic rings are oriented at dihedral angles of 75.64 (3) and 83.14 (3)°. An N-H⋯O hydrogen bond links the two mol-ecules. Weak intramolecular C-H⋯O inter-actions are observed in the two mol-ecules. In the crystal structure, inter-molecular N-H⋯O and C-H⋯O inter-actions link the mol-ecules into a two-dimensional network.

摘要

标题化合物C(14)H(13)NO(3)的不对称单元包含两个晶体学独立分子,其中芳环的二面角分别为75.64 (3)°和83.14 (3)°。一个N-H⋯O氢键连接这两个分子。在这两个分子中观察到弱的分子内C-H⋯O相互作用。在晶体结构中,分子间的N-H⋯O和C-H⋯O相互作用将分子连接成二维网络。

https://cdn.ncbi.nlm.nih.gov/pmc/blobs/8278/2977260/afd884aba477/e-65-o1997-fig2.jpg
https://cdn.ncbi.nlm.nih.gov/pmc/blobs/8278/2977260/c274381b0c7e/e-65-o1997-fig1.jpg
https://cdn.ncbi.nlm.nih.gov/pmc/blobs/8278/2977260/afd884aba477/e-65-o1997-fig2.jpg
https://cdn.ncbi.nlm.nih.gov/pmc/blobs/8278/2977260/c274381b0c7e/e-65-o1997-fig1.jpg
https://cdn.ncbi.nlm.nih.gov/pmc/blobs/8278/2977260/afd884aba477/e-65-o1997-fig2.jpg

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本文引用的文献

1
Structure validation in chemical crystallography.化学晶体学中的结构验证
Acta Crystallogr D Biol Crystallogr. 2009 Feb;65(Pt 2):148-55. doi: 10.1107/S090744490804362X. Epub 2009 Jan 20.
2
A short history of SHELX.SHELX简史。
Acta Crystallogr A. 2008 Jan;64(Pt 1):112-22. doi: 10.1107/S0108767307043930. Epub 2007 Dec 21.