Ionization potential (I), electron affinity (A), electronegativity (X), global hardness (η), chemical potential (μ), global electrophilicity (ω), electron donor capability (ω−), electron acceptor capability (ω+) and global softness (σ) values of 6a–d (units in eV).
| Com | I | A | X | η | μ | ω | ω − | ω + | σ |
|---|---|---|---|---|---|---|---|---|---|
| 6a | 4.80 | 4.43 | 4.62 | 0.18 | −4.62 | 57.42 | 59.75 | 55.13 | 2.69 |
| 6b | 5.46 | 4.63 | 5.04 | 0.41 | −5.04 | 30.79 | 33.36 | 28.32 | 1.21 |
| 6c | 5.20 | 4.43 | 4.81 | 0.38 | −4.81 | 30.09 | 32.55 | 27.73 | 1.30 |
| 6d | 5.14 | 4.43 | 4.78 | 0.35 | −4.78 | 32.16 | 34.59 | 29.81 | 1.41 |