QUANTUM MECHANICAL CALCULATIONS OF IR SPECTRA; REACTION ENERGIES OF C-O (R-O) THERMAL BOND RUPTURE FOR CEFUROXIME PRODRUGS
QUANTUM MECHANICAL CALCULATIONS OF IR SPECTRA; REACTION ENERGIES OF C-O (R-O) THERMAL BOND RUPTURE FOR CEFUROXIME PRODRUGS

REHAB MAJED KUBBA; THANA MAHDEE AL. MOUAMIN

Volume 6, Issue 3 , December 2012, , Page 90-101

https://doi.org/10.37652/juaps.2012.77623

Abstract
  PM3 calculations were carried out for the estimation vibration frequencies, IR absorption intensities, normal coordinates and some physical properties as heat of formation, dipole moment, ...  Read More ...