Interaction Scheme
Molecule
1-Adamantane acetate
Host
β-CD
Indicator
Phenolphthalein
Binding Properties
| 𝜈 | Molecule 1 : 1 Host | ||
| Ka = | 1.07⋅105 | ± 2000.0 | M-1 |
| Kd = | |||
| logKa = | |||
| T | 25.0 °C | ||
| Energy | kJ mol-1 | kcal mol-1 | |||
|---|---|---|---|---|---|
| ΔG | = | -28.71 | ± 0.05 | -6.86 | ± 0.01 |
| ΔH | = | -33.1 | ± 1.7 | -7.91 | ± 0.41 |
| -TΔS | = | 4.4 | ± 1.5 | 1.05 | ± 0.36 |
| J mol-1 K-1 | cal mol-1 K-1 | ||||
| ΔS | = | -14.8 | ± 5.0 | -3.5 | ± 1.2 |
These are the specifications of the determination of the experimental results.
| Detection Method: | Competitive | |||
| Assay Type: | Competitive Binding Assay | |||
| Technique: | Absorbance | |||
| 𝛌abs | = | 552.0 nm | ||
Detailed information about the solvation.
| Solvent System | Complex Mixture |
| Solvents | water |
| Additives | Sodium carbonate |
| sodium bicabonate | |
| potassium chloride | |
| Total concentration | 150.0 mM |
| pH | 9.94 |
Please find here information about the dataset this interaction is part of.
| Citation: |
R. I. Gelb, S. Raso, J. S. Alper, SupraBank 2025, Complexation reactions of β-cyclodextrin, per-(2,3,6-O-methyl) cycloheptaamylose and γ-cyclodextrin with phenolphthalein, adamantane carboxylate and adamantane acetate (dataset). https://doi.org/10.34804/supra.20210928269 |
| Link: | https://doi.org/10.34804/supra.20210928269 |
| Export: | BibTex | RIS | EndNote |
Please find here information about the scholarly article describing the results derived from that data.
| Citation: |
R. I. Gelb, S. Raso, J. S. Alper, Supramolecular Chemistry 1995, 4, 279–285. |
| Link: | https://doi.org/10.1080/10610279508028937 |
| Export: | BibTex | RIS | EndNote |
Binding Isotherm Simulations
The plot depicts the binding isotherm simulation of a 1:1 interaction of 1-Adamantane acetate (0.00018691588785046728 M) and β-CD (0 — 0.00037383177570093456 M).
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