Study of the interaction of imidazolidine-2-thione with molecular iodine

被引：11
|
作者：
Chernov'yants, M. S. [1 ]
Kolesnikova, T. S. [1 ]
Suponitsky, K. Yu. [2 ]
机构：
[1] Southern Fed Univ, Dept Chem, 7 Ul Zorge, Rostov Na Donu 344090, Russia
[2] Russian Acad Sci, AN Nesmeyanov Inst Organoelement Cpds, 28 Ul Vavilova, Moscow 119991, Russia
来源：
RUSSIAN CHEMICAL BULLETIN | 2016年 / 65卷 / 03期
基金：
俄罗斯科学基金会;
关键词：
imidazolidine-2-thione; molecular adduct (C3H6N2S)(2)center dot 3I(2); UV spectroscopy; Raman spectroscopy; X-ray diffraction; CRYSTAL-STRUCTURES; THIOAMIDES; COMPLEXES; DIIODINE;
D O I：
10.1007/s11172-016-1379-y
中图分类号：
O6 [化学];
学科分类号：
0703 ;
摘要：
The crystal and molecular structure of the reaction product of imidazolidine-2-thione and molecular iodine of the composition (C3H6N2S)2aEuro cent 3I(2) was established by X-ray diffraction. The crystal structure is composed of strongly connected five-component associates consisting of three I-2 molecules and two heterocyclic molecules. Quantum chemical calculations followed by the topological analysis of the electron density function provided an estimate of the strongest intermolecular interactions in the crystal structure of the molecular adduct.
引用
收藏
页码：811 / 815
页数：5
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