Table 5. Partial Molecular Orbital Energy of the Complex.
| orbital | HOMO – 2 | HOMO – 1 | HOMO | LUMO | LUMO + 1 | LUMO + 2 |
|---|---|---|---|---|---|---|
| energy (eV) | –8.9812 | –8.5008 | –8.3299 | –5.3199 | –5.0689 | –3.9819 |
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