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N,N'-双(4-溴-2-氟苄叉基)乙烷-1,2-二胺

N,N'-Bis(4-bromo-2-fluoro-benzyl-idene)ethane-1,2-diamine.

作者信息

Fun Hoong-Kun, Kia Reza

机构信息

X-ray Crystallography Unit, School of Physics, Universiti Sains Malaysia, 11800 USM, Penang, Malaysia.

出版信息

Acta Crystallogr Sect E Struct Rep Online. 2008 Sep 13;64(Pt 10):o1941-2. doi: 10.1107/S1600536808029000.

DOI:10.1107/S1600536808029000
PMID:21201147
原文链接:https://pmc.ncbi.nlm.nih.gov/articles/PMC2959256/
Abstract

The mol-ecule of the title Schiff base compound, C(16)H(12)Br(2)F(2)N(2), lies across a crystallographic inversion centre and adopts an E configuration with respect to the azomethine C=N bonds. The imino groups are coplanar with the aromatic rings. Within the mol-ecule, the planar units are parallel, but extend in opposite directions from the dimethyl-ene bridge. An inter-esting feature of the crystal structure is the short inter-molecular Br⋯F inter-actions [3.2347 (16) Å, which is shorter than the sum of the van der Waals radii of these atoms]. These inter-actions link neighbouring mol-ecules along the c axis. The crystal structure is further stabilized by inter-molecular C-H⋯N hydrogen bonds.

摘要

标题席夫碱化合物C(16)H(12)Br(2)F(2)N(2)的分子位于一个晶体学反演中心上,且相对于偶氮甲碱C=N键采取E构型。亚氨基与芳环共面。在分子内,平面单元相互平行,但从亚甲基桥向相反方向延伸。晶体结构的一个有趣特征是短的分子间Br⋯F相互作用[3.2347 (16) Å,短于这些原子的范德华半径之和]。这些相互作用沿着c轴连接相邻分子。晶体结构通过分子间C-H⋯N氢键进一步稳定。

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本文引用的文献

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2
N,N'-Bis(4-bromo-benzyl-idene)butane-1,4-diamine.N,N'-双(4-溴苄叉基)丁烷-1,4-二胺
Acta Crystallogr Sect E Struct Rep Online. 2008 Sep 6;64(Pt 10):o1894. doi: 10.1107/S1600536808028122.
3
N,N'-Bis(2-iodo-benzyl-idene)ethane-1,2-diamine.N,N'-双(2-碘苄叉基)乙烷-1,2-二胺
Acta Crystallogr Sect E Struct Rep Online. 2008 Sep 6;64(Pt 10):o1870-1. doi: 10.1107/S1600536808027608.
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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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