Contours for selected orbitals with the contributions to their creation for compound 14 (pyrene/pyridyl/triazolyl).
| HOMO | LUMO | ΔE [eV] | |
|---|---|---|---|
| 14 |
|
|
3.19 |
| −5.21 | −2.02 | ||
| 75/10/15 | 74/15/11 |
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