Abstract

AbstractThe interaction of some neutral acids of π type, bearing appropriate unsymmetrical substitutions at the CC group with some selected bases (H2O, NH3, OH−), is compared with that of the parent compound of a new set of neutral π acids, bearing symmetrical substitutions at the CC group with the same bases. The analyses of the interaction energy, performed according to two decomposition schemes, with and without the counterpoise corrections, make clear the similarity of symmetrically and unsymmetrically substituted neutral organic acids.

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