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(E)-4-溴-N-(2,4-二甲氧基-亚苄基)苯胺

(E)-4-Bromo-N-(2,4-dimethoxy-benzyl-idene)aniline.

作者信息

Khalaji Aliakbar D, Simpson Jim

出版信息

Acta Crystallogr Sect E Struct Rep Online. 2009 Feb 21;65(Pt 3):o553. doi: 10.1107/S1600536809004905.

DOI:10.1107/S1600536809004905
PMID:21582212
原文链接:https://pmc.ncbi.nlm.nih.gov/articles/PMC2968501/
Abstract

The title Schiff base compound, C(15)H(14)BrNO(2), adopts an E configuration with respect to the C=N bond. The C and O atoms of the two meth-oxy substituents lie very close to the dimethoxy-phenyl ring plane [maximum deviation = 0.17 (1) Å]. The dihedral angle between the two aromatic rings is 43.69 (16)°, while the plane through the central C-C=N-C system is inclined at 10.6 (6)° to the dimethoxy-phenyl ring and 34.6 (3)° to the bromo-phenyl ring. In the crystal structure, each mol-ecule is involved in the formation of two inversion-related dimers through weak C-H⋯N and C-H⋯O inter-actions, respectively. These contacts link the mol-ecules into independent rows parallel to the b axis.

摘要

席夫碱化合物C(15)H(14)BrNO(2)相对于C=N键采取E构型。两个甲氧基取代基的C和O原子非常靠近二甲氧基苯环平面[最大偏差 = 0.17 (1) Å]。两个芳香环之间的二面角为43.69 (16)°,而通过中心C-C=N-C体系的平面相对于二甲氧基苯环倾斜10.6 (6)°,相对于溴苯环倾斜34.6 (3)°。在晶体结构中,每个分子分别通过弱C-H⋯N和C-H⋯O相互作用参与形成两个与反演相关的二聚体。这些接触将分子连接成平行于b轴的独立行。

https://cdn.ncbi.nlm.nih.gov/pmc/blobs/6404/2968501/5e6de1611dc8/e-65-0o553-fig2.jpg
https://cdn.ncbi.nlm.nih.gov/pmc/blobs/6404/2968501/7372a3386a7f/e-65-0o553-fig1.jpg
https://cdn.ncbi.nlm.nih.gov/pmc/blobs/6404/2968501/5e6de1611dc8/e-65-0o553-fig2.jpg
https://cdn.ncbi.nlm.nih.gov/pmc/blobs/6404/2968501/7372a3386a7f/e-65-0o553-fig1.jpg
https://cdn.ncbi.nlm.nih.gov/pmc/blobs/6404/2968501/5e6de1611dc8/e-65-0o553-fig2.jpg

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