TABLE 2.
Electrostatic Dipoles for the Ion Pair Form of the Acid–Base Pair (A−·BH+) Calculated at the 6-31+G**//6-31G* Level
| base | GB(base)a (kcal/mol) | μBH+·A− (D) |
|---|---|---|
| MTBD | 246.2 | 11.0 |
| TBD | 244.3 | 14.2 |
| DBU | 242.7 | 14.4 |
| DBN | 240.4 | 12.9 |
| TMG | 238.4 | 13.7 |
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