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N,N',N''-三环己基碘化胍

N,N',N''-Tricyclo-hexyl-guanidinium iodide.

作者信息

Said Farouq F, Ali Basem F, Richeson Darrin

出版信息

Acta Crystallogr Sect E Struct Rep Online. 2011 Dec 1;67(Pt 12):o3467. doi: 10.1107/S1600536811049683. Epub 2011 Nov 30.

Abstract

In the title compound, C(19)H(36)N(3) (+)·I(-), the orientation of the cyclo-hexyl rings around the planar (sum of N-C-N angles = 360°) CN(3) (+) unit produces steric hindrance around the N-H groups. As a consequence of this particular orientation of the tricyclo-hexyl-guanidinium cation (hereafter denoted CHGH(+)), hydrogen bonding is restricted to classical N-H⋯I and non-clasical (cyclo-hex-yl)C-H⋯I hydrogen bonds. The propeller CHGH(+) cation and the oriented hydrogen-bonding interactions lead to a three-dimensional supra-molecular structure.

摘要

在标题化合物C(19)H(36)N(3) (+)·I(-)中,环己基环围绕平面型(N-C-N角之和 = 360°)的CN(3) (+)单元的取向在N-H基团周围产生空间位阻。由于三环己基胍阳离子(以下简称CHGH(+))的这种特殊取向,氢键作用仅限于经典的N-H⋯I和非经典的(环己基)C-H⋯I氢键。螺旋桨状的CHGH(+)阳离子和定向的氢键相互作用导致了三维超分子结构。

https://cdn.ncbi.nlm.nih.gov/pmc/blobs/79e2/3239094/b3b2a0fae70e/e-67-o3467-fig1.jpg

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