The geometry of calcium acetylacetonate, Ca(acac)2, has been optimized at the B3LYP level, using 6-311G* and 6-311++G** basis sets. The vibrational frequencies and potential energy distribution (PED) of the internal ...

Fourier transform Raman (3200–150 cm−1) and infrared (4000–100 cm−1) spectral measurements have been made for the solid copper (II) benzoylacetonate, Cu(bzac)2 and, for comparison, copper (II) acetylacetonate, Cu(acac)2. ...

Conformational analysis, molecular structure, relative stability, and complete vibrational assignment of bis(2,2,6,6-tetramethylheptane-3,5-dionato)copper(II), Cu(tmhd)2, were investigated by density functional theory ...