Computational study on stereoselective synthesis of substituted 1H-tetrazoles via a click reaction: DFT and QTAIM approaches

Published 2015 View Full Article

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Title
Computational study on stereoselective synthesis of substituted 1H-tetrazoles via a click reaction: DFT and QTAIM approaches
Authors
Keywords
Click reaction, 5-substituted 1H-tetrazoles, DFT calculations, Polarized continuum model, QTAIM analysis
Journal
Computational and Theoretical Chemistry
Volume 1071, Issue -, Pages 53-60
Publisher
Elsevier BV
Online
2015-09-02
DOI
10.1016/j.comptc.2015.08.014

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