Reaction Details | |
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Cell Reactant: | BDBM11 |
Syringe Reactant: | BDBM36265 |
Meas. Tech.: | ITC |
Entry Date: | 01/03/11 |
ΔG°: | -5.83±0 (kcal/mole) |
pH: | 7.2±0 |
Log10Kb: | 4.27± 2.04 |
Temperature: | 298.15±0 (K) |
ΔH° : | -4.99±0.130 (kcal/mole) |
ΔHobs: | n/a |
Ionic Strength: | n/a |
n/a | |
Protons Released: | n/a |
ΔCp : | n/a |
Stoich. Param.: | n/a |
ΔS° : | 0±0 (kcal/mole-K) |
Comments: | First trial |
Citation | Liu, Y; Yang, EC; Yang, YW; Zhang, HY; Fan, Z; Ding, F; Cao, R Thermodynamics of the molecular and chiral recognition of cycloalkanols and camphor by modified beta-cyclodextrins possessing simple aromatic tethers. J Org Chem69:173-80 (2004) [PubMed] 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 |
Name | BDBM11 |
Synonyms: | beta-cyclodextrin | betadex |
Type | Molecular 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 | |
BDBM36265 | |
Source: | n/a |
Purity: | n/a |
Prep. Method: | n/a |
Name | BDBM36265 |
Synonyms: | (+)-borneol |
Type | Guest |
Emp. Form. | C10H18O |
Mol. Mass. | 154.2493 |
SMILES | CC1(C)[C@@H]2CC[C@@]1(C)[C@@H](O)C2 |THB:9:8:1:4.5| |
Structure |
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