Table 5.
Values for chemical potential and electrophilicity (in vacuo/with solvent).
| compound | chemical potential (μ) (eV) |
electrophilicity (W) (eV) |
|---|---|---|
| 3 | −10.64/−4.91 | 20.65/3.27 |
| 4 | −10.80/−4.94 | 20.65/3.31 |
| 5 | −10.53/−4.89 | 21.53/3.30 |
| 6 | −10.25/−4.79 | 22.76/3.24 |
| 7 | −9.93/−4.52 | 24.48/3.14 |