Ab initio molecular orbital calculations on anions. Determination of gas phase acidities

1 January 1974

journal article
Published by Royal Society of Chemistry (RSC) in Journal of the Chemical Society, Chemical Communications

No. 10,p. 403-404
https://doi.org/10.1039/c39740000403

Abstract

Relative acidities deduced from ab initio molecular orbital calculations are found to be in reasonable agrreement with experimental gas-phase values.

Keywords

MOLECULAR ORBITAL
INITIO MOLECULAR
ACIDITIES RELATIVE
GAS PHASE
EXPERIMENTAL
ANIONS
AGRREEMENT
DEDUCED

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