2D spectrochemical series of ML6 metal complexes for controlling the ligand field splitting

Ishii, Tomohiko; Tsuboi, Shino; Yukinari, Shohei; Sakane, Genta; Yamashita, Masahiro; Breedlove, Brian K.

metal complex, spectrochemical series, ligand field splitting, coordination chemistry
We have studied a novel universal spectrochem. series of the six-coordinated octahedral 3d transition metal complexes that can be used for any combinations of the central metal atoms and the ligand mols.  The spectrochem. series for the six-coordinated octahedral metal complexes can be well explained by the energy level comparison between the metals and ligands using the DV-Xα method.  The two-dimensional spectrochem. series can be applied for expecting of the ligand field splitting energy widths of not only the known compds. but also the unknown ones.

International Journal of Quantum Chemistry

John Wiley & Sons, Inc.

109

12

2734

2743