Interaction Scheme
Molecule
7-Methoxycoumarin
Host
Octa-(6-O-(1-ethoxypropan-2-ol))-γ-CD
Binding Properties
| 𝜈 | Molecule 1 : 1 Host | ||
| Ka = | 42.0 | ± 6.0 | M-1 |
| Kd = | |||
| logKa = | |||
| T | 25.0 °C | ||
| Energy | kJ mol-1 | kcal mol-1 | |||
|---|---|---|---|---|---|
| ΔG | = | -9.27 | ± 0.36 | -2.22 | ± 0.09 |
These are the specifications of the determination of the experimental results.
| Detection Method: | Direct | |||
| Assay Type: | Direct Binding Assay | |||
| Technique: | Fluorescence | |||
| 𝛌ex | = | 320.0 nm | ||
| 𝛌em | = | 395.0 nm | ||
| Ibound⁄Ifree | = | 0.6 | ||
Detailed information about the solvation.
| Solvent System | Single Solvent |
| Solvent | water |
Please find here information about the dataset this interaction is part of.
| Citation: |
B. D. Wagner, S. J. Fitzpatrick, G. J. McManus, SupraBank 2024, Fluorescence Suppression of 7-Methoxycoumarin upon Inclusion into Cyclodextrins (dataset). https://doi.org/10.34804/supra.20210928397 |
| Link: | https://doi.org/10.34804/supra.20210928397 |
| Export: | BibTex | RIS | EndNote |
Please find here information about the scholarly article describing the results derived from that data.
| Citation: |
B. D. Wagner, S. J. Fitzpatrick, G. J. McManus, Journal of Inclusion Phenomena 2003, 47, 187–192. |
| Link: | https://doi.org/10.1023/B:JIPH.0000011779.65838.44 |
| Export: | BibTex | RIS | EndNote |
Binding Isotherm Simulations
The plot depicts the binding isotherm simulation of a 1:1 interaction of 7-Methoxycoumarin (0.47619047619047616 M) and Octa-(6-O-(1-ethoxypropan-2-ol))-γ-CD (0 — 0.9523809523809523 M).
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