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Energy value of EHOMO, ELUMO, ΔE, ɳ, χ, μ and ω of the best five compounds (178, 53, 140, 173 &124).
| CMPD | EHOMO | ELUMO | ΔE | μ | ɳ | Χ | Ω |
|---|---|---|---|---|---|---|---|
| 178 | -0.16947 | -0.13643 | -0.03304 | -0.15295 | 0.01652 | 0.15295 | 0.70805 |
| 53 | -0.22716 | -0.08723 | -0.13993 | -0.15719 | 0.01796 | 0.15719 | 0.17658 |
| 140 | -0.18815 | -0.14363 | -0.04452 | -0.16589 | 0.02226 | 0.16589 | 0.61814 |
| 173 | -0.23145 | -0.09110 | -0.14035 | -0.16127 | 0.07017 | 0.16127 | 0.18531 |
| 124 | -0.23801 | -0.11537 | -0.12264 | -0.17669 | 0.06132 | 0.17669 | 0.25456 |
