Your browser doesn't support javascript.
loading
Tris-{hydridotris(1-pyrazolyl)borato}actinide Complexes: Synthesis, Spectroscopy, Crystal Structure, Bonding Properties and Magnetic Behaviour.
Apostolidis, Christos; Kovács, Attila; Walter, Olaf; Colineau, Eric; Griveau, Jean-Christophe; Morgenstern, Alfred; Rebizant, Jean; Caciuffo, Roberto; Panak, Petra J; Rabung, Thomas; Schimmelpfennig, Bernd; Perfetti, Mauro.
Afiliación
  • Apostolidis C; European Commission, Joint Research Centre, Postfach 2340, 76125, Karlsruhe, Germany.
  • Kovács A; European Commission, Joint Research Centre, Postfach 2340, 76125, Karlsruhe, Germany.
  • Walter O; European Commission, Joint Research Centre, Postfach 2340, 76125, Karlsruhe, Germany.
  • Colineau E; European Commission, Joint Research Centre, Postfach 2340, 76125, Karlsruhe, Germany.
  • Griveau JC; European Commission, Joint Research Centre, Postfach 2340, 76125, Karlsruhe, Germany.
  • Morgenstern A; European Commission, Joint Research Centre, Postfach 2340, 76125, Karlsruhe, Germany.
  • Rebizant J; European Commission, Joint Research Centre, Postfach 2340, 76125, Karlsruhe, Germany.
  • Caciuffo R; European Commission, Joint Research Centre, Postfach 2340, 76125, Karlsruhe, Germany.
  • Panak PJ; Institut für Nukleare Entsorgung, Forschungszentrum Karlsruhe, Postfach 3640, 76021, Karlsruhe, Germany.
  • Rabung T; Institut für Nukleare Entsorgung, Forschungszentrum Karlsruhe, Postfach 3640, 76021, Karlsruhe, Germany.
  • Schimmelpfennig B; Institut für Nukleare Entsorgung, Forschungszentrum Karlsruhe, Postfach 3640, 76021, Karlsruhe, Germany.
  • Perfetti M; Department of Chemistry, University of Copenhagen, Universitetsparken 5, 2100, Copenhagen, Denmark.
Chemistry ; 26(49): 11293-11306, 2020 Sep 01.
Article en En | MEDLINE | ID: mdl-32519790
ABSTRACT
The isostructural compounds of the trivalent actinides uranium, neptunium, plutonium, americium, and curium with the hydridotris(1-pyrazolyl)borato (Tp) ligand An[η3 -HB(N2 C3 H3 )3 ]3 (AnTp3 ) have been obtained through 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.
Palabras clave

Texto completo: 1 Colección: 01-internacional Base de datos: MEDLINE Idioma: En Revista: Chemistry Asunto de la revista: QUIMICA Año: 2020 Tipo del documento: Article País de afiliación: Alemania

Texto completo: 1 Colección: 01-internacional Base de datos: MEDLINE Idioma: En Revista: Chemistry Asunto de la revista: QUIMICA Año: 2020 Tipo del documento: Article País de afiliación: Alemania
...