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(E)-3-[(3-乙氧基-2-羟基-亚苄基)氨基]-苯甲酸

(E)-3-[(3-Eth-oxy-2-hy-droxy-benzyl-idene)amino]-benzoic acid.

作者信息

Kargar Hadi, Sharafi Zahra, Kia Reza, Tahir Muhammad Nawaz

出版信息

Acta Crystallogr Sect E Struct Rep Online. 2012 Apr 1;68(Pt 4):o1035. doi: 10.1107/S1600536812009968. Epub 2012 Mar 10.

DOI:10.1107/S1600536812009968
PMID:22589906
原文链接:https://pmc.ncbi.nlm.nih.gov/articles/PMC3343997/
Abstract

In the title compound, C(16)H(15)NO(4), a potential bidentate N,O-donor Schiff base ligand, the benzene rings are inclined to one another by 4.24 (12)°. The mol-ecule has an E conformation about the C=N bond. An intra-molecular O-H⋯N hydrogen bond makes an S(6) ring motif. In the crystal, pairs of O-H⋯O hydrogen bonds link the mol-ecules, forming inversion dimers with R(2) (2)(8) ring motifs. These dimers are further connected by C-H⋯O inter-actions, forming a sheet in (104). There is also a C-H⋯π inter-action present involving neighbouring mol-ecules.

摘要

在标题化合物C(16)H(15)NO(4)中,它是一种潜在的双齿N,O供体席夫碱配体,苯环彼此间倾斜4.24 (12)°。分子围绕C=N键呈E构象。分子内的O-H⋯N氢键形成了一个S(6)环模式。在晶体中,成对的O-H⋯O氢键连接分子,形成具有R(2) (2)(8)环模式的反演二聚体。这些二聚体通过C-H⋯O相互作用进一步连接,在(104)方向形成一个平面。还存在涉及相邻分子的C-H⋯π相互作用。

https://cdn.ncbi.nlm.nih.gov/pmc/blobs/d9fb/3343997/79cec10d28db/e-68-o1035-fig2.jpg
https://cdn.ncbi.nlm.nih.gov/pmc/blobs/d9fb/3343997/2c33e3ebbcdb/e-68-o1035-fig1.jpg
https://cdn.ncbi.nlm.nih.gov/pmc/blobs/d9fb/3343997/79cec10d28db/e-68-o1035-fig2.jpg
https://cdn.ncbi.nlm.nih.gov/pmc/blobs/d9fb/3343997/2c33e3ebbcdb/e-68-o1035-fig1.jpg
https://cdn.ncbi.nlm.nih.gov/pmc/blobs/d9fb/3343997/79cec10d28db/e-68-o1035-fig2.jpg

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本文引用的文献

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