Reaction Details
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Cell Reactant:
BDBM36273
Syringe Reactant:
BDBM36274
Meas. Tech.:
ITC
Entry Date.:
01/03/10
ΔG°:
-7±0.02 (kcal/mole)
Log10Kb:
3.6
Temperature:
298.15±0 (K)
ΔH° :
-11.77±0.16 (kJ/mole)
ΔS° :
-0.02±0 (kJ/mole-K)
Comments:
First trial
Citation
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Cell React
Name:
BDBM36273
Synonyms:
alpha-cyclodextrin dimer singly bridged dimer, 10
Type:
Molecular Host
Emp. Form.:
C72H118O58S2
Mol. Mass.:
1975.803
SMILES:
OC[C@H]1O[C@@H]2O[C@@H]3[C@@H](CO)O[C@H](O[C@@H]4[C@@H](CO)O[C@H](O[C@@H]5[C@@H](CSSC[C@H]6O[C@@H]7O[C@@H]8[C@@H](CO)O[C@H](O[C@@H]9[C@@H](CO)O[C@H](O[C@@H]%10[C@@H](CO)O[C@H](O[C@@H]%11[C@@H](CO)O[C@H](O[C@@H]%12[C@@H](CO)O[C@H](O[C@H]6[C@H](O)[C@H]7O)[C@H](O)[C@H]%12O)[C@H](O)[C@H]%11O)[C@H](O)[C@H]%10O)[C@H](O)[C@H]9O)[C@H](O)[C@H]8O)O[C@H](O[C@@H]6[C@@H](CO)O[C@H](O[C@@H]7[C@@H](CO)O[C@H](O[C@H]1[C@H](O)[C@H]2O)[C@H](O)[C@H]7O)[C@H](O)[C@H]6O)[C@H](O)[C@H]5O)[C@H](O)[C@H]4O)[C@H](O)[C@H]3O