Tris-{Hydridotris(1-pyrazolyl)borato}actinide Complexes: Synthesis, Spectroscopy, Crystal Structure, Bonding Properties and Magnetic Behaviour
The isostructural compounds with the hydridotris(1-pyrazolyl)borato (Tp) ligand An[3-HB(N2C3H3)3]3 (AnTp3) of the trivalent actinides uranium, neptunium, plutonium, americium, and curium have been obtained via several synthetic routes. Structural, spectroscopic (absorption, infrared, laser fluorescence) and magnetic characterisation of the compounds were performed in combination with crystal field, Density Functional Theory (DFT), and relativistic multiconfigurational calculations. The covalent bonding interactions were analysed in terms of the Natural Bond Orbital (NBO) and Quantum Theory of Atoms in Molecules (QTAIM) models.
APOSTOLIDIS Christos;
KOVACS Attila;
WALTER Olaf;
COLINEAU Eric;
GRIVEAU Jean-Christophe;
MORGENSTERN Alfred;
REBIZANT J.;
CACIUFFO Roberto;
PANAK P.;
RABUNG T.;
SCHIMMELPFENNIG Bernd;
PERFETTI Mauro;
2020-09-03
WILEY-V C H VERLAG GMBH
JRC118656
0947-6539 (online),
https://publications.jrc.ec.europa.eu/repository/handle/JRC118656,
10.1002/chem.202001095 (online),
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