Investigation of the Zero-Field Splitting in Six- and Seven-Coordinate Mononuclear MnII Complexes with N/O-Based Ligands by Combining EPR Spectroscopy and Quantum Chemistry.

{The electronic properties of seven mononuclear Mn(II) complexes with an N/O and N/Cl coordination sphere were investigated by X- and Q-band EPR spectroscopy as well as by d. functional theory (DFT). The [Mn(terpy)(CF3CO2)2(H2O)] (1), [Mn(pb)2(CF3SO3)2] (2), [Mn(pb)2(NO3)(H2O)](NO3) (3), [Mn(bpy)2(CF3CO2)2] (4) and [Mn(pb)2Cl2] (5) complexes are six-coordinate, whereas [Mn(terpy)(NO3)2(H2O)] (6) and [Mn(bpea)(NO3)2] (7) are seven-coordinate [terpy = 2,2':6,2''-terpyridine

Références

Titre
Investigation of the Zero-Field Splitting in Six- and Seven-Coordinate Mononuclear MnII Complexes with N/O-Based Ligands by Combining EPR Spectroscopy and Quantum Chemistry.
Type de publication
Article de revue
Année de publication
2010
Revue
Eur. J. Inorg. Chem.
Pagination
3658–3665
ISSN
1434-1948
Soumis le 12 avril 2018