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Reaction Details
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Cell Reactant:BDBM11
Syringe Reactant:BDBM36257
Meas. Tech.:ITC
Entry Date:12/21/10
 
ΔG°:-5.48± (kcal/mole)
pH:n/a
Log10Kb:4± 0.0414
Temperature:298±0 (K)
ΔH° :-4.18±0.0100 (kcal/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± (kcal/mole-K)
Comments:First trial
 
Citation Danil de Namor AFTraboulssi RLewis DF Host properties of cyclodextrins towards anion constituents of antigenic determinants. A thermodynamic study in water and in N,N-dimethylformamide J Am Chem Soc 112:8442-7 (1990)    Article
More Info.:  Get all data from this article ,  ITC RUN data ,  Solution Info ,  Instrument Info
 
BDBM11
Source:n/a
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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BDBM36257
Source:n/a
Purity:n/a
Prep. Method:n/a
NameBDBM36257
Synonyms:3-[(4-hydroxyphenyl)azo]benzoate
TypeGuest
Emp. Form.C13H9N2O3
Mol. Mass.241.2227
SMILESOc1ccc(cc1)N=Nc1cccc(c1)C([O-])=O |w:7.7|
Structure
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