Table 1. Kinetic parameters determined for the thread and rotaxane from fitting of the kinetic data shown in Fig. 4, 8 and 9 to the appropriate model. Simulation and fitting were performed using SimFit (G. von Kiedrowski, University of Bochum, 2008). The Ka for duplex [T·T] was determined to be 4.8 × 104 M–1 and the Ka for the pseudorotaxane [L·M] was determined to be 220 M–1.
Thread | Rotaxane | |
trans | trans | |
k bi/10–4 M–1 s–1 | 7.73 | 5.80 |
k AB/10–4 s–1 | 0.15 | 0.092 |
k SR/10–4 s–1 | 3.62 | — |
EMAB/mM | 20 | 16 |
EMSR/mM | 470 | — |