KID Descriptor | Value |
HOMO | −5.8260 |
LUMO | −1.1268 |
SOMO | −1.1467 |
HL gap | 4.6991 |
JI | 0.0336 |
JA | 0.0110 |
JHL | 0.0353 |
ΔSL | 0.0199 |