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Cell Reactant:BDBM36127
Syringe Reactant:BDBM36116
Meas. Tech.:ITC
Entry Date:10/15/10
 
ΔG°:-3.15±0.0200 (kcal/mole)
pH:6.9±0
Log10Kb:2.30± 0.699
Temperature:298.15±0 (K)
ΔH° :-2.32±0.0700 (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±0 (kcal/mole-K)
Comments:First trial
 
Citation Rekharsky MVInoue Y Complexation and chiral recognition thermodynamics of 6-amino-6-deoxy-beta-cyclodextrin with anionic, cationic, and neutral chiral guests: counterbalance between van der Waals and coulombic interactions. J Am Chem Soc 124:813-26 (2002) [PubMed]  Article
More Info.:  Get all data from this article ,  ITC RUN data ,  Solution Info ,  Instrument Info
 
BDBM36127
Source:n/a
Purity:n/a
Prep. Method:n/a
NameBDBM36127
Synonyms:6-Amino-6-deoxy-beta-cyclodextrin (am-beta-CD) | 6-NH2-beta-cyclodextrin | mono(6-amino-6-deoxy)-beta-cyclodextrin
TypeMolecular Host
Emp. Form.C42H72NO34
Mol. Mass.1135.0068
SMILES[NH3+]C[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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BDBM36116
Source:13214-66-9 (Aldrich)
Purity:n/a
Prep. Method:n/a
NameBDBM36116
Synonyms:4-phenylbutylamine
TypeGuest
Emp. Form.C10H16N
Mol. Mass.150.2402
SMILES[NH3+]CCCCc1ccccc1
Structure
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