Abstract

Calculs SCF-MO ab initio pour les complexes H 2 (CH 3 )Nb=CH 2 , (CO) 5 Cr≡CH + , Cl(CO) 4 Cr≡CH: charges negatives des atomes C de carbene et carbyne, energies orbitales. Interpretation des reactivites en termes d'orbitales frontieres

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