Calculated DEIE for Cl− and Br− binding. Goodness of fit (R2) of the titration data to eqn (1) through linear regression is included in parentheses.
| 13C NMR Signal | DEIE (R2) | |
|---|---|---|
| Carbon | Cl− | Br− |
| Cab | 0.983 ± 0.017 (0.997) | 1.006 ± 0.010 (0.999) |
| C1 | 1.006 ± 0.007 (0.999) | 1.009 ± 0.018 (0.997) |
| C1 | 1.014 ± 0.002 (1.00) | 0.990 ± 0.046 (0.981) |