Complexes of 4-Substituted Phenolates with HF and HCN: Energy Decomposition and Electronic Structure Analyses of Hydrogen Bonding

H. Szatylowicz, T.M. Krygowski, C. Fonseca Guerra, F.M. Bickelhaupt

Research output: Contribution to JournalArticleAcademicpeer-review

Abstract

We have computationally studied para-X-substituted phenols and phenolates (X = NO, NO
Original languageEnglish
Pages (from-to)696-705
JournalJournal of Computational Chemistry
Volume2013
Issue number34
DOIs
Publication statusPublished - 2013

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