Table 3.
|
Anion association constants K a [M−1] for 3⋅ChBR series[a] |
|
|||||||||||
---|---|---|---|---|---|---|---|---|---|---|---|---|---|
Anion[b] |
pOMe |
pMe |
Ph [c] |
pF |
pCl |
mF |
mCF3 |
pCF3 |
2F [c] |
3F [c] |
2CF3 |
ρ [g] |
r [h] |
Cl− |
450 |
1140 |
1360 |
1610 |
4790 |
14 000[f] |
>105[d] |
>105[d] |
>105[d] |
>105[d] |
>105[d] |
2.20±0.29 |
0.97 |
Br− |
230 |
518 |
822 |
863 |
2540 |
2740 |
7540 |
7270 |
5180 |
11 800[f] |
19 900[f] |
1.59±0.13 |
0.97 |
I− |
NB[e] |
NB[e] |
119 |
398 |
674 |
592 |
1450 |
1620 |
1040 |
1750 |
3980 |
1.28±0.23 |
0.90 |
[a] Association constants determined by Bindfit analysis of Te‐aryl chemical shift perturbations unless otherwise specified, errors ≤10 % unless otherwise specified, conducted in [D6]acetone. [b] Anions added as their tetrabutylammonium salts. [c] Determined by monitoring of internal pyridine proton signal. [d] Too large to be accurately quantified by1H NMR titration. [e] No binding. [f] Error ≤26 %. [g] ρ refers to the value from the Hammett equation [h] Pearson's correlation coefficient.