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A simple link between hydrocarbon and borohydride chemistries

A clear link between the hydrocarbon and borohydride chemistries is established by showing that hydrocarbons and borohydrides have a common root regulated by the number of valence electrons in a confined space. Application of the proposed method to archetypal hydrocarbons leads to well-known borohydrides but, more importantly, it allows the design of new and interesting boron-containing molecules that can be a source of inspiration for synthetic chemists

The authors are grateful to the following organizations for financial support: the Ministerio de Ciencia e Innovacin (MICINN; project numbers CTQ2010-16237/BQU, CTQ2011-23156/BQU, and CTQ2011-25086/BQU), the Generalitat de Catalunya (project numbers 2009SGR279, 2009SGR637) and Xarxa de Referencia en Quimica Teorica i Computacional, and the FEDER fund (European Fund for Regional Development) for the grant UNGI08-4E-003

Wiley-VCH Verlag

Manager: Ministerio de Ciencia e Innovación (Espanya)
Generalitat de Catalunya. Agència de Gestió d’Ajuts Universitaris i de Recerca
Author: Teixidor Bombardó, Francesc
Poater i Teixidor, Jordi
Solà i Puig, Miquel
Viñas, Clara
Date: 2013
Abstract: A clear link between the hydrocarbon and borohydride chemistries is established by showing that hydrocarbons and borohydrides have a common root regulated by the number of valence electrons in a confined space. Application of the proposed method to archetypal hydrocarbons leads to well-known borohydrides but, more importantly, it allows the design of new and interesting boron-containing molecules that can be a source of inspiration for synthetic chemists
The authors are grateful to the following organizations for financial support: the Ministerio de Ciencia e Innovacin (MICINN; project numbers CTQ2010-16237/BQU, CTQ2011-23156/BQU, and CTQ2011-25086/BQU), the Generalitat de Catalunya (project numbers 2009SGR279, 2009SGR637) and Xarxa de Referencia en Quimica Teorica i Computacional, and the FEDER fund (European Fund for Regional Development) for the grant UNGI08-4E-003
Format: application/pdf
Document access: http://hdl.handle.net/10256/11430
Language: eng
Publisher: Wiley-VCH Verlag
Collection: info:eu-repo/semantics/altIdentifier/doi/10.1002/chem.201204397
info:eu-repo/semantics/altIdentifier/issn/0947-6539
info:eu-repo/semantics/altIdentifier/eissn/1521-3765
info:eu-repo/grantAgreement/MICINN//CTQ2011-23156/ES/AVANCES EN CATALISIS Y AROMATICIDAD/
info:eu-repo/grantAgreement/MICINN//CTQ2011-25086/ES/MODELIZACION MULTIESCALAR EN (BIO)QUIMICA/
AGAUR/2009-2014/2009 SGR-279
AGAUR/2009-2014/2009 SGR-637
Rights: Tots els drets reservats
Subject: Bor
Boron
Hidrocarburs
Hydrocarbons
Funcional de densitat, Teoria del
Density functionals
Enllaços químics
Chemical bonds
Title: A simple link between hydrocarbon and borohydride chemistries
Type: info:eu-repo/semantics/article
Repository: DUGiDocs

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