Interaction Scheme
Molecule
2-Adamantylamine hydrochloride
Host
β-CD
Indicator
METHYL ORANGE
Binding Properties
| 𝜈 | Molecule 1 : 1 Host | ||
| Ka = | 7413.1 | ± 855.35 | M-1 |
| Kd = | |||
| logKa = | |||
| T | 25.0 °C | ||
| Energy | kJ mol-1 | kcal mol-1 | |||
|---|---|---|---|---|---|
| ΔG | = | -22.09 | ± 0.29 | -5.28 | ± 0.07 |
| ΔH | = | -21.8 | ± 0.8 | -5.21 | ± 0.19 |
| -TΔS | = | -0.2 | ± 0.7 | -0.05 | ± 0.17 |
| J mol-1 K-1 | cal mol-1 K-1 | ||||
| ΔS | = | 0.7 | ± 2.3 | 0.2 | ± 0.6 |
These are the specifications of the determination of the experimental results.
| Detection Method: | Competitive | |||
| Assay Type: | Competitive Binding Assay | |||
| Technique: | Absorbance | |||
| 𝛌abs | = | 530.0 nm | ||
Detailed information about the solvation.
| Solvent System | Complex Mixture |
| Solvents | water |
| Additives | hydrochloric acid |
| pH | 2.5 |
Please find here information about the dataset this interaction is part of.
| Citation: |
R. I. Gelb, L. M. Schwartz, SupraBank 2024, Complexation of adamantane-ammonium substrates by beta-cyclodextrin and itsO-methylated derivatives (dataset). https://doi.org/10.34804/supra.20210928268 |
| Link: | https://doi.org/10.34804/supra.20210928268 |
| Export: | BibTex | RIS | EndNote |
Please find here information about the scholarly article describing the results derived from that data.
| Citation: |
R. I. Gelb, L. M. Schwartz, J Incl Phenom Macrocycl Chem 1989, 7, 537–543. |
| Link: | https://doi.org/10.1007/BF01080464 |
| Export: | BibTex | RIS | EndNote | |
Binding Isotherm Simulations
The plot depicts the binding isotherm simulation of a 1:1 interaction of 2-Adamantylamine hydrochloride (0.0026979266433745665 M) and β-CD (0 — 0.005395853286749133 M).
Please sign in: customize the simulation by signing in to the SupraBank.
