Abstract
Potential interaction surface of polyhydrated monomethyl mercury cation with inorganic ligands (X = Cl, Br, I, HO, HS, HSe) has been studied by quantum chemical methods. Thermodynamic and kinetic parameters of complexation processes were determined. A relative stability of polyhydrated complexes (Me-Hg—X) to the dissociation of coordination bond Hg—X was found to increase in the series: HO ≪ I < Br < HS < HSe < Cl.
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