Reaction Details | |
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Cell Reactant: | BDBM4 |
Syringe Reactant: | BDBM36147 |
Meas. Tech.: | ITC |
Entry Date: | 10/30/10 |
ΔG°: | -1.34± (kcal/mole) |
pH: | 7.2±0 |
Log10Kb: | 0.980± 0.0414 |
Temperature: | 298.15±0 (K) |
ΔH° : | -6±0.0500 (kcal/mole) |
ΔHobs: | n/a |
Ionic Strength: | n/a |
n/a | |
Protons Released: | n/a |
ΔCp : | n/a |
Stoich. Param.: | n/a |
ΔS° : | -0.0200± (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 |
BDBM4 | |
Source: | 10016-20-3 |
Purity: | n/a |
Prep. Method: | n/a |
Name | BDBM4 |
Synonyms: | (1S,3R,5R,6S,8R,10R,11S,13R,15R,16S,18R,20R,21S,23R,25R,26S,28R,30R,31R,32R,33R,34R,35R,36R,37R,38R,39R,40R,41R,42R)-5,10,15,20,25,30-hexakis(hydroxymethyl)-2,4,7,9,12,14,17,19,22,24,27,29-dodecaoxaheptacyclo[26.2.2.2^{3,6}.2^{8,11}.2^{13,16}.2^{18,21}.2^{23,26}]dotetracontane-31,32,33,34,35,36,37,38,39,40,41,42-dodecol | alpha-cyclodextrin |
Type | Molecular Host |
Emp. Form. | C36H60O30 |
Mol. Mass. | 972.8436 |
SMILES | [H]C12OC(CO)C([H])(OC3([H])OC(CO)C([H])(OC4([H])OC(CO)C([H])(OC5([H])OC(CO)C([H])(OC6([H])OC(CO)C([H])(OC7([H])OC(CO)C([H])(O1)C(O)C7O)C(O)C6O)C(O)C5O)C(O)C4O)C(O)C3O)C(O)C2O |
Structure | |
BDBM36147 | |
Source: | n/a |
Purity: | n/a |
Prep. Method: | n/a |
Name | BDBM36147 |
Synonyms: | 2,7-naphthalenedisulfonate |
Type | Guest |
Emp. Form. | C10H6O6S2 |
Mol. Mass. | 286.282 |
SMILES | [O-]S(=O)(=O)c1ccc2ccc(cc2c1)S([O-])(=O)=O |
Structure |
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