Title of article
The ethyl cation as proton donor for dihydrogen bonds in the image (m = 1 or 2 and n = 1 or 2) complex: A theoretical study
Author/Authors
Boaz G. Oliveira، نويسنده , , M?rio L.A.A. Vasconcellos، نويسنده ,
Issue Information
روزنامه با شماره پیاپی سال 2009
Pages
3
From page
1142
To page
1144
Abstract
BHandHLYP/6-31G(d,p) calculations and molecular integrations of the quantum theory of atoms in molecules (QTAIM) were applied to study a new class of dihydrogen-bonded complexes (image with m = 1 or 2 and n = 1 or 2) based on the assumption that earth alkaline hydride MgH2 can bind with the non-localized hydrogen H+δ of the ethyl cation image.
Keywords
Hyperconjugation , Dihydrogen bonds , Ethyl cation , QTAIM
Journal title
Inorganic Chemistry Communications
Serial Year
2009
Journal title
Inorganic Chemistry Communications
Record number
1318295
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