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Does metallophilicity increase or decrease down group 11? Computational investigations of [Cl–M–PH3]2(M = Cu, Ag, Au, [111])

Published in Physical Chemistry Chemical Physics • Jan 1, 2004
NobleIDNI0P67W96R15S25
Authors:
Emma O'Grady
,
Nikolas Kaltsoyannis

Abstract

The electronic and geometric structures of Cl–M–PH3 and [Cl–M–PH3]2 (M = Cu, Ag, Au, [111]) have been studied computationally using post Hartree–Fock ab initio and density functional methods. The trends in r(M–Cl) and r(M–P) in the monomers are discussed in the light of previous studies. Previous MP...

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