Abstract:A novel scheme has been proposed by computational methods (B3LYP and CCSD(T)) to produce hydroxylamine under normal experimental conditions using [O 3 Re-(NH 2 )] and H 2 O 2 under basic conditions. This particular reaction may proceed similar to Baeyer-Villiger oxidation and μ-peroxo type pathways to insert oxygen into the Re-NH 2 bond to yield NH 2 OH; nevertheless, Baeyer-Villiger type oxidation is seems to be more viable. The calculated energy barriers further revealed that the introduction of different s… Show more
Set email alert for when this publication receives citations?
scite is a Brooklyn-based organization that helps researchers better discover and understand research articles through Smart Citations–citations that display the context of the citation and describe whether the article provides supporting or contrasting evidence. scite is used by students and researchers from around the world and is funded in part by the National Science Foundation and the National Institute on Drug Abuse of the National Institutes of Health.