Computational modeling of mixed-ligand cobalt diketonate complexes with pyrene-4,5,9,10-tetraimine
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DOI: 10.1134/s0012500817080079
Abstract: Quantum-chemical modeling (DFT UB3LYP*/6-311++G(d,p)) of binuclear mixed-ligand cobalt diketonate complexes with pyrene-4,5,9,10-tetraimine has been performed. Equilibrium geometries and stabilization energies of all the electromeric forms of the studied adducts have been calculated, and the exchange… read more here.
Keywords: cobalt diketonate; diketonate complexes; pyrene tetraimine; mixed ligand ... See more keywords