of the present paper is to investigate the structure of bis(3-amino-1-phenyl-2-buten-1-onato) copper(II) (Cu(APBO)2) and to determine its kf by means of density functional theory (DFT). The calculated geometrical parameters for this complex will be compared...

The bis(3-amino-1-phenyl-2-buten-1-onato)copper(II) complex, Cu(APBO)2, has been characterized by

ab initio calculations and vibrational spectroscopic techniques. The geometry optimization are performed

at the UB3LYP level using 6-311G...