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Interpreting the electronic structure of the hydrogen-bridge bond in B2H6through a hypothetical reaction

โœ Scribed by Rongbao Liao

Publisher
Springer
Year
2011
Tongue
English
Weight
481 KB
Volume
23
Category
Article
ISSN
1040-0400

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A new mechanism of H2B๎—ปNH2 formation in
A new mechanism of H2B๎—ปNH2 formation in the reaction of B2H6 with NH3
โœ Shogo Sakai ๐Ÿ“‚ Article ๐Ÿ“… 1994 ๐Ÿ› Elsevier Science ๐ŸŒ English โš– 405 KB

The mechanisms of the reactions of diborane with ammonia have been investigated by ab initio molecular orbital methods. The activation barrier of the formation of aminoborane, H,&NHr, from the adduct, H,B : NHs, of borane and ammonia is high (over 40 kcal/mol), because it is a reaction essentially