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（±）-1,2-双（N'-苯甲酰基-硫代脲基）环己烷

(±)-1,2-Bis(N'-benzoyl-thio-ureido)cyclo-hexa-ne.

作者信息

Jumal Juliana, Ibrahim Abdul Razak, Yamin Bohari M

出版信息

Acta Crystallogr Sect E Struct Rep Online. 2011 May 1;67(Pt 5):o1256. doi: 10.1107/S1600536811014991. Epub 2011 Apr 29.

DOI:10.1107/S1600536811014991
PMID:21754546
原文链接:https://pmc.ncbi.nlm.nih.gov/articles/PMC3089146/
Abstract

In the title compound, C(22)H(24)N(4)O(2)S(2), the two thio-urea segments of the side-arm groups are inclined at a dihedral angle of 73.09 (9)°. The central cyclo-hexane bridge adopts a chair conformation. The mol-ecule is stabilized by N-H⋯O intra-molecular hydrogen bonds forming S(6) rings, and N-H⋯O and N-H⋯S inter-molecular hydrogen bonds forming infinite chains developing parallel to the b axis.

摘要

在标题化合物C(22)H(24)N(4)O(2)S(2)中，侧链基团的两个硫脲片段以73.09 (9)°的二面角倾斜。中心环己烷桥采取椅式构象。分子通过形成S(6)环的N-H⋯O分子内氢键以及形成平行于b轴延伸的无限链的N-H⋯O和N-H⋯S分子间氢键得以稳定。

https://cdn.ncbi.nlm.nih.gov/pmc/blobs/9595/3089146/86c5c4b3f150/e-67-o1256-fig2.jpg
https://cdn.ncbi.nlm.nih.gov/pmc/blobs/9595/3089146/75798c9f0e8e/e-67-o1256-fig1.jpg
https://cdn.ncbi.nlm.nih.gov/pmc/blobs/9595/3089146/86c5c4b3f150/e-67-o1256-fig2.jpg
https://cdn.ncbi.nlm.nih.gov/pmc/blobs/9595/3089146/75798c9f0e8e/e-67-o1256-fig1.jpg
https://cdn.ncbi.nlm.nih.gov/pmc/blobs/9595/3089146/86c5c4b3f150/e-67-o1256-fig2.jpg

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