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Listar por palabra clave "Density functional theory calculations"

Mostrando ítems 1-1 de 1

High-valent bis(oxo)-bridged dinuclear manganese oxamates: Synthesis, crystal structures, magnetic properties, and electronic structure calculations of bis(n-oxo)dimanganese(IV) complexes with a binucleating o-phenylenedioxamate ligand

Ruiz-García, R.; Pardo, E.; Muñoz Roca, María Del Carmen; Cano, J. (Elsevier, 2007-01-01)

[EN] Two novel bis(oxo)-bridged dinuclear manganese(IV) complexes with the binucleating ligand o-phenylenebis(oxamate) (opba), formulated as (Me4N)(4)[Mn2O2(opba)(2)] (1a) and (Me4N)(2)(Ph4P)(2)[Mn2O2(opba)(2)] (.) 8H(2)O ...

Mostrando ítems 1-1 de 1