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Bond indices in dihydrogen bonds

Name: Bond indices in dihydrogen bonds
Keywords: dihydrogen bonds, multicenter bond index

descriptionPublicationkeyboard_double_arrow_right Article 01 Jan 2008 English Publisher:FapUNIFESP (SciELO)Journal:Journal of the Brazilian Chemical Society, volume 19 (eissn: 0103-5053,

Authors: Giambiagi, Myriam M. Segre de; Bultinck, Patrick;

doi: 10.1590/s0103-50532008000200009

Bond indices in dihydrogen bonds

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Abstract

Os indices de ligacao de tres centros levam a uma descricao nova da ligacao di-hidrogenio XH...H'M como sendo uma superposicao de uma ponte de hidrogenio usual XHH', mais uma ponte de hidrogenio forte HH'M. O indice de ligacao de quatro centros e negativo e o seu valor e intermediario entre os anteriores.

Related Organizations

Centro Brasileiro de Pesquisas Físicas
Brazil
Ghent University
Belgium

Keywords

dihydrogen bonds, multicenter bond index

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