A. Antinolo et al., DELOCALIZATION OF THE UNPAIRED SPIN-DENSITY IN SOME NIOBOCENE COMPLEXES WITH SIGMA-DONOR, PI-ACCEPTORS, Journal of organometallic chemistry, 470(1-2), 1994, pp. 127-130
Extended Huckel calculations and qualitative MO have been used to anal
yze the EPR data relevant to the localization of the unpaired spin den
sity in several paramagnetic niobocene complexes with sigma-donor pi-a
cceptors, acetylene, aldehyde, ketene, ketenimine, and carbon disulfid
e.