VIBRATIONAL ASSIGNMENTS OF RESONANCE RAMAN LINES OF NI(OCTAETHYLPORPHYRIN) ON THE BASIS OF A NORMAL COORDINATE TREATMENT

Motoko Abe, Teizo Kitagawa, Yoshimasa Kyōgoku

Chemistry Letters · 1976 · 26 citations · 13 references

Concepts

Abstract

Abstract Vibrational modes for the resonance Raman lines of Ni(OEP) have been obtained on the basis of a normal coordinate analysis. The Raman line at 1383 cm−1, which corresponds to an oxidation-state marker band of hemoproteins, is mainly due to the breathing mode of the pyrrole rings. The vibrations of the sixteen-membered inner ring contribute to the Raman bands sensitive to the spin-states of the heme iron.

References

13