Research Article
Synthesis and Biological Evaluation of Novel Zn(II) and Cd(II) Schiff Base Complexes as Antimicrobial, Antifungal, and Antioxidant Agents
Table 3
Some energetic properties of the DMPTHP ligand and M(II)-DMPTHP complexes.
| Ligand/complex | Total energy (kcal/mol) | Binding energy (kcal/mol) | Electronic energy (kcal/mol) | Nuclear energy (kcal/mol) | Dipole moment (debye) |
| DMPTHP | −65204.4 | −3726.1 | −447505.9 | 382301.5 | 3.55 | Zn-L | −72869.8 | −3792.7 | −515891.3 | 443021.4 | 2.76 | Cd-L | −72725.7 | −3762.4 | −498546.9 | 425821.2 | 2.63 |
|
|