M. Bossa et al., ON THE ELECTRONIC STATES OF MACROCYCLES OF THE EXTENDED PORPHYRIN FAMILY AND THEIR COORDINATION-COMPOUNDS, Journal of molecular structure. Theochem, 390, 1997, pp. 101-107
The electronic absorption spectra of Ni, Zn and Mg hemiporphyrazine de
rivatives are presented and discussed together with theoretical result
s obtained by INDO/S computations. The absorption spectra of all the m
etal derivatives show marked red shifts of the lowest energy absorptio
n bands with respect to those of the metal free hemiporphyrazine. The
possible explanation that in metal derivatives low lying excited state
s with a fully conjugated pi electron system are present is supported
by theoretical computations.