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| Reaction Details | |
|---|---|
 | Report a problem with these data |
| Cell Reactant: | BDBM36281 |
| Syringe Reactant: | BDBM36259 |
| Meas. Tech.: | ITC |
| Entry Date: | 01/10/11 |
| Δ G ° : | n/a |
| pH: | n/a |
| Log10Kb: | 12.6± 12.0 |
| Temperature: | 298.15±0 (K) |
| ΔH° : | -21.3±0.720 (kcal/mole) |
| ΔHobs: | n/a |
| Ionic Strength: | n/a |
| n/a | |
| Protons Released: | n/a |
| ΔCp : | n/a |
| Stoich. Param.: | n/a |
| ΔS° : | -0.0100±0 (kcal/mole-K) |
| Comments: | First trial |
| Citation |  Jeon, WS; Moon, K; Park, SH; Chun, H; Ko, YH; Lee, JY; Lee, ES; Samal, S; Selvapalam, N; Rekharsky, MV; Sindelar, V; Sobransingh, D; Inoue, Y; Kaifer, AE; Kim, K Complexation of ferrocene derivatives by the cucurbit[7]uril host: a comparative study of the cucurbituril and cyclodextrin host families. J Am Chem Soc127:12984-9 (2005) [PubMed] Article |
| More Info.: | Get all data from this article , ITC RUN data , Solution Info , Instrument Info |
| BDBM36281 | |
| Source: | n/a |
| Purity: | n/a |
| Prep. Method: | n/a |
| Name | BDBM36281 |
| Synonyms: | BDBM197279 | cucurbit[7]uril |
| Type | Molecular Host |
| Emp. Form. | C42H42N28O14 |
| Mol. Mass. | 1162.9621 |
| SMILES | O=C1N2CN3[C@@H]4[C@@H]5N(CN6[C@@H]7[C@@H]8N(CN9[C@@H]%10[C@@H]%11N(CN%12[C@@H]%13[C@@H]%14N(CN%15[C@@H]%16[C@@H]%17N(CN%18[C@@H]%19[C@@H]%20N(CN1[C@@H]1[C@H]2N2CN4C(=O)N5CN7C(=O)N8CN%10C(=O)N%11CN%13C(=O)N%14CN%16C(=O)N%17CN%19C(=O)N%20CN1C2=O)C%18=O)C%15=O)C%12=O)C9=O)C6=O)C3=O |
| Structure | 
|
| BDBM36259 | |
| Source: | n/a |
| Purity: | n/a |
| Prep. Method: | n/a |
| Name | BDBM36259 |
| Synonyms: | (ferrocenemethyl)trimethylamine, 3+ | alkyldimethyl(ferrocenylmethy1)ammonium (1+) |
| Type | Guest |
| Emp. Form. | C9H15N |
| Mol. Mass. | 137.2221 |
| SMILES | C[N+](C)(C)Cc1ccc[cH-]1 |
| Structure | 
|
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