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（E）-N'-[1-（2,4-二羟基苯基）亚乙基]肼基甲酸甲酯

Methyl (E)-N'-[1-(2,4-dihydroxy-phen-yl)ethyl-idene]hydrazinecarboxyl-ate.

作者信息

Lv Lu-Ping, Li Wei-Wei, Yu Wen-Bo, Yu Tie-Ming, Hu Xian-Chao

出版信息

Acta Crystallogr Sect E Struct Rep Online. 2009 Jul 18;65(Pt 8):o1896. doi: 10.1107/S1600536809027317.

DOI:10.1107/S1600536809027317
PMID:21583586
原文链接:https://pmc.ncbi.nlm.nih.gov/articles/PMC2977410/
Abstract

The mol-ecule of the title compound, C(10)H(12)N(2)O(4), adopts a trans configuration with respect to the C=N bond. The dihedral angle between the benzene ring and the methyl hydrazinecarboxyl-ate plane is 3.01 (6)°. An intra-molecular O-H⋯N hydrogen bond is observed. In the crystal, mol-ecules are linked into a two-dimensional network parallel to (10) by O-H⋯O, N-H⋯O and C-H⋯O hydrogen bonds.

摘要

标题化合物C(10)H(12)N(2)O(4)的分子相对于C=N键呈反式构型。苯环与甲基肼羧酸酯平面之间的二面角为3.01 (6)°。观察到分子内存在O-H⋯N氢键。在晶体中，分子通过O-H⋯O、N-H⋯O和C-H⋯O氢键连接成平行于(10)的二维网络。

https://cdn.ncbi.nlm.nih.gov/pmc/blobs/685c/2977410/f8950574494c/e-65-o1896-fig2.jpg
https://cdn.ncbi.nlm.nih.gov/pmc/blobs/685c/2977410/8f811134d52f/e-65-o1896-fig1.jpg
https://cdn.ncbi.nlm.nih.gov/pmc/blobs/685c/2977410/f8950574494c/e-65-o1896-fig2.jpg
https://cdn.ncbi.nlm.nih.gov/pmc/blobs/685c/2977410/8f811134d52f/e-65-o1896-fig1.jpg
https://cdn.ncbi.nlm.nih.gov/pmc/blobs/685c/2977410/f8950574494c/e-65-o1896-fig2.jpg

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本文引用的文献

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(E)-Methyl N'-[1-(4-methoxy-phen-yl)ethyl-idene]hydrazinecarboxyl-ate.（E）-N'-[1-（4-甲氧基苯基）亚乙基]肼基甲酸甲酯
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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.
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Design, synthesis, and evaluation of Phe-Gly mimetics: heterocyclic building blocks for pseudopeptides.
J Med Chem. 1999 Oct 21;42(21):4331-42. doi: 10.1021/jm990197+.