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2,2'-{(1,1')-[乙烷-1,2-二基双(氮杂亚基)]双(亚甲基)}双(4-碘苯酚)。

2,2'-{(1,1')-[Ethane-1,2-diylbis(aza-nylyl-idene)]bis-(methanylyl-idene)}bis-(4-iodo-phenol).

作者信息

Blackwelder Lauren A, Kelley Andrea R, Balaich Gary J, Jefferies Latisha R

机构信息

Department of Chemistry, US Air Force Academy, CO, 80840, USA.

出版信息

IUCrdata. 2022 Sep 13;7(Pt 9):x220895. doi: 10.1107/S2414314622008951. eCollection 2022 Sep.

DOI:10.1107/S2414314622008951
PMID:36337458
原文链接:https://pmc.ncbi.nlm.nih.gov/articles/PMC9635427/
Abstract

The title compound, CHINO, a di-iodo-Schiff base, crystallizes in space group with one mol-ecule per asymmetric unit. The mol-ecular structure reveals two intra-molecular O-H⋯N hydrogen bonds that give the mol-ecule a twisted structure with non-coplanar rings. In the crystal structure, the mol-ecular packing is stabilized by π-π stacking, hydrogen- and halogen-bonding (C-H⋯I; O⋯I) inter-actions.

摘要

标题化合物CHINO,一种二碘席夫碱,结晶于空间群,每个不对称单元中有一个分子。分子结构显示出两个分子内O-H⋯N氢键,使分子具有扭曲结构且环不共面。在晶体结构中,分子堆积通过π-π堆积、氢键和卤键(C-H⋯I;O⋯I)相互作用得以稳定。

https://cdn.ncbi.nlm.nih.gov/pmc/blobs/fd3b/9635427/fed150cf5565/x-07-x220895-fig3.jpg
https://cdn.ncbi.nlm.nih.gov/pmc/blobs/fd3b/9635427/e59351e7ee9a/x-07-x220895-fig1.jpg
https://cdn.ncbi.nlm.nih.gov/pmc/blobs/fd3b/9635427/68a9fed1a1f4/x-07-x220895-fig2.jpg
https://cdn.ncbi.nlm.nih.gov/pmc/blobs/fd3b/9635427/fed150cf5565/x-07-x220895-fig3.jpg
https://cdn.ncbi.nlm.nih.gov/pmc/blobs/fd3b/9635427/e59351e7ee9a/x-07-x220895-fig1.jpg
https://cdn.ncbi.nlm.nih.gov/pmc/blobs/fd3b/9635427/68a9fed1a1f4/x-07-x220895-fig2.jpg
https://cdn.ncbi.nlm.nih.gov/pmc/blobs/fd3b/9635427/fed150cf5565/x-07-x220895-fig3.jpg

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本文引用的文献

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Antibiotics (Basel). 2022 Feb 1;11(2):191. doi: 10.3390/antibiotics11020191.
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1H-NMR作为含酚天然产物和模型化合物分子内和分子间氢键的结构分析工具。
Molecules. 2014 Sep 2;19(9):13643-82. doi: 10.3390/molecules190913643.