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Reaction Details
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Cell Reactant:BDBM11
Syringe Reactant:BDBM36146
Meas. Tech.:ITC
Entry Date:10/30/10
 
ΔG°:-30.7± (kJ/mole)
pH:7.2±0
Log10Kb:5.37± 0.0792
Temperature:298.15±0 (K)
ΔH° :-29.4±0.25 (kJ/mole)
ΔHobs:n/a
Ionic Strength:n/a
Corrected for ΔHioniz:n/a
Protons Released:n/a
ΔCp :n/a
Stoich. Param.:n/a
ΔS° : 0.0045± (kJ/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
NameBDBM11
Synonyms:beta-cyclodextrin | betadex
TypeMolecular 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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BDBM36146
Source:n/a
Purity:n/a
Prep. Method:n/a
NameBDBM36146
Synonyms:2-naphthalenesulfonate | napsylate
TypeGuest
Emp. Form.C10H7O3S
Mol. Mass.207.226
SMILES[O-]S(=O)(=O)c1ccc2ccccc2c1
Structure
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Last update November 1, 2007
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