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| Reaction Details | |
|---|---|
 | Report a problem with these data |
| Cell Reactant: | BDBM11 |
| Syringe Reactant: | BDBM50216627 |
| Meas. Tech.: | ITC |
| Entry Date: | 12/08/10 |
| ΔG°: | -6.31±0.0200 (kcal/mole) |
| pH: | 7±0 |
| Log10Kb: | 4.55± 3.08 |
| Temperature: | 303.25±0 (K) |
| ΔH° : | -6.84±0.0400 (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 |  Carrazana, J; Jover, A; Meijide, F; Soto, VH; Vazquez Tato, J Complexation of adamantyl compounds by beta-cyclodextrin and monoaminoderivatives. J Phys Chem B109:9719-26 (2005) [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 | 
|
| BDBM50216627 | |
| Source: | n/a |
| Purity: | n/a |
| Prep. Method: | n/a |
| Name | BDBM50216627 |
| Synonyms: | (alpha-methyl-1-adamantyl)methylamine | 1-Adamantan-1-yl-ethylamine | CHEMBL959 | RIMANTADINE | US11241393, Rimantadine | rimantadin | rimantidin |
| Type | Small organic molecule |
| Emp. Form. | C12H21N |
| Mol. Mass. | 179.3018 |
| SMILES | CC(N)C12CC3CC(CC(C3)C1)C2 |TLB:10:5:12:9.8.11,10:9:12:6.5.4,THB:4:5:8:12.3.11,4:3:6.5.10:8,1:3:6.5.10:8| |
| Structure | 
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