1University of Babylon, College of Science, Babylon, Iraq
2AL-Mustaqbal University College, Babylon, Iraq
*Corresponding author: Hussein Neama Najeeb. University of Babylon, College of Science, Babylon, Iraq; E-mail: Dhifafhussein@yahoo.com
Online published on 6 April, 2019.
Density functional calculations have been performed to study the new metal complexes. Several molecular properties, such as conformational equilibrium, optimal geometry, and vibrational frequencies, have been computed for these molecules. Ionization energies, electronic affinity and energy gap, were also computed.
DFT, Rhenium, Complexes
