Reaction Details | |
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Cell Reactant: | BDBM11 |
Syringe Reactant: | BDBM36149 |
Meas. Tech.: | ITC |
Entry Date: | 10/30/10 |
ΔG°: | -4.5± (kcal/mole) |
pH: | 7.2±0 |
Log10Kb: | 3.29± 0.0414 |
Temperature: | 298.15±0 (K) |
ΔH° : | -2.79±0.0700 (kcal/mole) |
ΔHobs: | n/a |
Ionic Strength: | n/a |
n/a | |
Protons Released: | n/a |
ΔCp : | n/a |
Stoich. Param.: | n/a |
ΔS° : | 0.0100± (kcal/mole-K) |
Comments: | First trial |
Citation | Inoue, Y; Hakushi, T; Liu, Y; Tong, LH; Shen, BJ; Jin, DS Thermodynamics of molecular recognition by cyclodextrins. 1. Calorimetric titration of inclusion complexation of naphthalenesulfonates with .alpha.-, .beta.-, and .gamma.-cyclodextrins: enthalpy-entropy compensation J Am Chem Soc115:475-481 (1993) Article |
More Info.: | Get all data from this article , ITC RUN data , Solution Info , Instrument Info |
BDBM11 | |
Source: | 7585-39-9 |
Purity: | n/a |
Prep. Method: | n/a |
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 | |
BDBM36149 | |
Source: | n/a |
Purity: | n/a |
Prep. Method: | n/a |
Name | BDBM36149 |
Synonyms: | 2,6-naphthalenedisulfonate | CHEMBL319726 |
Type | Guest |
Emp. Form. | C10H6O6S2 |
Mol. Mass. | 286.282 |
SMILES | [O-]S(=O)(=O)c1ccc2cc(ccc2c1)S([O-])(=O)=O |
Structure |
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