(Xa-SW) molecular orbital calculations were performed on simple models of free and copper bound hydroperoxides. ... to form the hypothetical O22- dianion.62 Protonation splits the degenerate 7tb bonding and 7t* antibonding pairs of orbitalsanbsp;...
|Title||:||Spectroscopic and electronic structure studies of copper-oxygen complexes relevant to catalysis|
|Author||:||David E. Root, Stanford University. Dept. of Chemistry|