Reaction Details  Report a problem with these data
Cell Reactant:
BDBM11
Syringe Reactant:
BDBM36253
Meas. Tech.:
ITC
Entry Date.:
12/08/10
ΔG°:
-21.17±0.03 (kJ/mole)
pH:
7.2±0
Log10Kb:
1.8
Temperature:
298.15±0 (K)
ΔH° :
-20.56±0.16 (kJ/mole)
ΔS° :
0.0021±0.0006 (kJ/mole-K)
Comments:
First trial
Citation
 Liu, Y; Cao, R; Chen, Y; He, JY Effect of beta-cyclodextrin charge type on the molecular recognition thermodynamics of reactions with (ferrocenylmethyl)dimethylaminium derivatives. J Phys Chem B 112:1445-50 (2008) [PubMed]  Article
Cell React
Source:
7585-39-9
Name:
BDBM11
Synonyms:
beta-cyclodextrin | betadex
Type:
Molecular Host
Emp. Form.:
C42H70O35
Mol. Mass.:
1134.9842
SMILES:
[H][C@]1(CO)O[C@]2([H])O[C@]3([H])[C@@]([H])(CO)O[C@]([H])(O[C@]4([H])[C@@]([H])(CO)O[C@]([H])(O[C@]5([H])[C@@]([H])(CO)O[C@]([H])(O[C@]6([H])[C@@]([H])(CO)O[C@]([H])(O[C@]7([H])[C@@]([H])(CO)O[C@]([H])(O[C@]8([H])[C@@]([H])(CO)O[C@]([H])(O[C@@]1([H])[C@]([H])(O)[C@@]2([H])O)[C@]([H])(O)[C@@]8([H])O)[C@]([H])(O)[C@@]7([H])O)[C@]([H])(O)[C@@]6([H])O)[C@]([H])(O)[C@@]5([H])O)[C@]([H])(O)[C@@]4([H])O)[C@]([H])(O)[C@@]3([H])O
Structure:
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Syringe React
Name:
BDBM36253
Synonyms:
FC8+Br-
Type:
Guest
Emp. Form.:
C16H29N
Mol. Mass.:
235.4082
SMILES:
CCCCCCCC[N+](C)(C)Cc1ccc[cH-]1
Structure:
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