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| Reaction Details | |
|---|---|
 | Report a problem with these data |
| Cell Reactant: | BDBM36250 |
| Syringe Reactant: | BDBM50216627 |
| Meas. Tech.: | ITC |
| Entry Date: | 12/08/10 |
| ΔG°: | -3.31±0.0100 (kcal/mole) |
| pH: | 7±0 |
| Log10Kb: | 2.38± 1.79 |
| Temperature: | 303.25±0 (K) |
| ΔH° : | -4.14±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 |
| BDBM36250 | |
| Source: | n/a |
| Purity: | n/a |
| Prep. Method: | n/a |
| Name | BDBM36250 |
| Synonyms: | 3-NH2-beta-cyclodextrin |
| Type | Molecular Host |
| Emp. Form. | C42H71NO34 |
| Mol. Mass. | 1133.9994 |
| SMILES | N[C@@H]1[C@@H](O)[C@@H]2O[C@H](CO)[C@H]1O[C@H]1O[C@H](CO)[C@@H](O[C@H]3O[C@H](CO)[C@@H](O[C@H]4O[C@H](CO)[C@@H](O[C@H]5O[C@H](CO)[C@@H](O[C@H]6O[C@H](CO)[C@@H](O[C@H]7O[C@H](CO)[C@@H](O2)[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)[C@H](O)[C@H]1O |
| 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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