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. 2022 May 11;13(24):7098–7125. doi: 10.1039/d2sc01800d

Station occupancy of the macrocycle of bistable [2]rotaxanes 1.XB/HB of the triazolium (Trz) and NDI stations in various solvents and in the presence of 1 equiv. of different anions as determined by 1H NMR90.

Anion 1.XB 1.HB
Trz NDI Δ(A–PF6) Trz NDI Δ(A–PF6)
CDCl3 PF6 38% 62% 76% 24%
Cl 92% 8% 54% 100% 0% 24%
I 95% 5% 57% 100% 0% 24%
CDCl3/MeOD 4 : 1 PF6 52% 48% 67% 33%
Cl 100% 0% 48% 87% 13% 20%
I 92% 8% 40% 70% 30% 3%
CDCl3/MeOD 1 : 1 PF6 33% 67% 33% 67%
Cl 48% 52% 15% 49% 51% 16%
I 63% 37% 30% 36% 64% 3%