Molecular structure of complexes with bifurcated hydrogen bond: III. Solvate H-complexes formed by trifluoromethanesulfonamide and its cyclic dimer

被引：7

作者：

Chipanina, NN ^{[1
]}

Aksamentova, TN ^{[1
]}

Sherstyannikova, LV ^{[1
]}

Sterkhova, IV ^{[1
]}

Shainyan, BA ^{[1
]}

Turchaninov, VK ^{[1
]}

机构：

[1] Russian Acad Sci, Siberian Div, Favorskii Irkutsk Inst Chem, Irkutsk 664033, Russia

来源：

RUSSIAN JOURNAL OF ORGANIC CHEMISTRY | 2005年 / 41卷 / 10期

关键词：

D O I：

10.1007/s11178-005-0360-2

中图分类号：

O62 [有机化学];

学科分类号：

070303 ; 081704 ;

摘要：

According to the data of IR spectroscopy, dielcometry, and B3LYP/6-31G* quantum-chemical calculations, trifluoromethanesulfonamide homoassociates in weakly basic protophilic media are converted into 2:1 solvate H-complexes. Cyclic trifluoromethanesulfonamide dimer decomposes in heteroassociate with dioxane with a composition of 1 :3. Cyclic trifluoromethanesulfonamide dimer with dioxane forms a 1: 4 H-complex with bifurcated (three-center) hydrogen bond involving the bridging hydrogen atom of the NH group ((NHO)-O-...).

引用

页码：1415 / 1420

页数：6

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