Table 1 Equilibrium constants and proposed coordination modes for Cu2+ complexes at T = 298 K and I = 0.1 M (KCl).
Species | Ac-VAIALKAAHYHTHKE (L1) | Ac-VAIALKAAHYHTHKE-NH2 (L2) | ||||
---|---|---|---|---|---|---|
logβ | pKa | Coordination | logβ | pKa | Coordination | |
[CuH2L]4+ | 18.21(3) | 4.40 | NIm, COO– | 23.06(4) | 5.49 | 2NIm |
[CuHL]3+ | 13.81(2) | 5.38 | 2NIm, COO– | 17.57(5) | 6.30 | 3NIm |
[CuL]2+ | 8.43(2) | 6.59 | 3NIm | 11.27(7) | 6.70 | 3NIm, N– |
[CuH-1L]+ | 1.84(3) | 6.88 | 3NIm, N– | 4.57(6) | 9.44 | 2NIm, 2N– |
[CuH-2L] | − 5.04(3) | – | 2NIm, 2N– | − 4.87(9) | 9.91 | 2NIm, 2N– |
[CuH-3L]– | – | – | – | − 14.78(7) | – | NIm, 3N– |
Species | VAIALKAAHYHTHKE-NH2 (L3) | |||||
---|---|---|---|---|---|---|
logβ | pKa | Coordination | ||||
[CuH5L]5+ | 51.38(2) | 5.16 | 2NIm | |||
[CuH4L]4+ | 46.21(2) | 6.21 | 3NIm | |||
[CuH3L]3+ | 40.00(3) | 6.90 | 2NIm, NH2 | |||
[CuH2L]2+ | 33.11(2) | 7.75 | 2NIm, NH2, N– | |||
[CuHL]+ | 25.36(3) | 9.53 | 2NIm, 2N– | |||
[CuL] | 15.83(5) | 10.01 | 2NIm, 2N– | |||
[CuH-1L]– | 5.82(4) | – | NIm, 3N– | |||
[CuH-3L]3– | − 15.03(9) | – | NIm, 3N– |