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A density functional study of open-shell cyclopentadienyl-molybdenum(II) complexes. A comparison of stabilizing factors: spin-pairing, Mo-X pi bonding, and release of steric pressure

Authors :
Cacelli, Ivo
Poli, Rinaldo
Quadrelli, Elsje Alessandra
Rizzo, Antonio
Smith, Kevin M.
Source :
Inorganic Chemistry. Feb 7, 2000, Vol. 39 Issue 3, p517, 8 p.
Publication Year :
2000

Abstract

Research has been conducted on the dissociation of PH (sub)3 from the 18-electron system CpMoX(PH (sub)3) (sub)3. The use of the density functional theory is examined.

Details

ISSN :
00201669
Volume :
39
Issue :
3
Database :
Gale General OneFile
Journal :
Inorganic Chemistry
Publication Type :
Academic Journal
Accession number :
edsgcl.59803651