Article ID Journal Published Year Pages File Type
5394683 Computational and Theoretical Chemistry 2012 6 Pages PDF
Abstract
► We investigated the intermolecular interaction of borazine with the first-row hydrides. ► In the B3N3H6-BH3, the B3N3H6 and BH3 are in the same units. ► The strength of the π-H interaction is enhanced as one progresses from CH4 to HF of the borazine complexes. ► Both electrostatic and dispersive energies are important in the description of these π-H interactions.
Related Topics
Physical Sciences and Engineering Chemistry Physical and Theoretical Chemistry
Authors
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