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The calculated deprotonation energies for compounds 1–4 at the HF/6-31G(d), HF/6-31+G(d), and MP2/6-31+G(d) levels of theory
| Compound | Deprotonation energy, kcal/mol
|
||
|---|---|---|---|
| HF/6-31G(d) | HF/6-31+G(d) | MP2/6-31+G(d) | |
| 1 | 389.8 | 380.1 | 363.9 |
| 2 | 380.5 | 371.8 | 354.0 |
| 3 | 374.0 | 365.4 | 349.0 |
| 4 | 369.2 | 361.6 | 347.4 |
