Reaction Details  Report a problem with these data
Cell Reactant:
BDBM11
Syringe Reactant:
BDBM36255
Meas. Tech.:
ITC
Entry Date.:
2010-12-21
ΔG°:
-20.0400±n/a (kJ/mole)
Log10Kb:
0.1
Temperature:
298.0000±0.0000 (K)
ΔH° :
-20.1000±0.6000 (kJ/mole)
Comments:
First trial
Citation
 Danil de Namor, AF; Traboulssi, R; Lewis, 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
Cell React
Name:
BDBM11
Synonyms:
betadex | beta-cyclodextrin
Type:
Molecular Host
Emp. Form.:
C42H70O35
Mol. Mass.:
1134.37
SMILES:
OC[C@H]1O[C@@H]2O[C@@H]3[C@@H](CO)O[C@H](O[C@@H]4[C@@H](CO)O[C@H](O[C@@H]5[C@@H](CO)O[C@H](O[C@@H]6[C@@H](CO)O[C@H](O[C@@H]7[C@@H](CO)O[C@H](O[C@@H]8[C@@H](CO)O[C@H](O[C@H]1[C@H](O)[C@H]2O)[C@H](O)[C@H]8O)[C@H](O)[C@H]7O)[C@H](O)[C@H]6O)[C@H](O)[C@H]5O)[C@H](O)[C@H]4O)[C@H](O)[C@H]3O
Structure:
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Syringe React
Name:
BDBM36255
Synonyms:
4-chloro-3-[(4-hydroxyphenyl)azo]benzoate
Type:
Guest
Emp. Form.:
n/a
Mol. Mass.:
n/a
SMILES:
Oc1ccc(cc1)N=Nc1cc(ccc1Cl)C([O-])=O |w:7.7|
Structure:
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