Interaction Scheme
Molecule
4-[2-[4-(dimethylamino)phenyl]ethenyl]-1-[2-(4-...
Host
CB7
Binding Properties
| 𝜈 | Molecule 1 : 1 Host | ||
| Ka = | 6.29⋅104 | ± 8800.0 | M-1 |
| Kd = | |||
| logKa = | |||
| T | 25.0 °C | ||
| Energy | kJ mol-1 | kcal mol-1 | |||
|---|---|---|---|---|---|
| ΔG | = | -27.39 | ± 0.35 | -6.55 | ± 0.08 |
These are the specifications of the determination of the experimental results.
| Detection Method: | Direct | |||
| Assay Type: | Direct Binding Assay | |||
| Technique: | Fluorescence | |||
| 𝛌ex | = | 461.0 nm | ||
| 𝛌em | = | 599.0 nm | ||
Detailed information about the solvation.
| Solvent System | Single Solvent |
| Solvent | water |
Please find here information about the dataset this interaction is part of.
| Citation: |
Q. Wang, H. Zhang, L. Liu, C. Gao, R. Sun, SupraBank 2024, Enhancing photostability of cyanine dye by cucurbituril encapsulation (dataset). https://doi.org/10.34804/supra.20231009493 |
| Link: | https://doi.org/10.34804/supra.20231009493 |
| Export: | BibTex | RIS | EndNote |
Please find here information about the scholarly article describing the results derived from that data.
| Citation: |
H. Zhang, L. Liu, C. Gao, R. Sun, Q. Wang, Dyes and Pigments 2012, 94, 266–270. |
| Link: | https://doi.org/10.1016/j.dyepig.2012.01.022 |
| Export: | BibTex | RIS | EndNote |
Binding Isotherm Simulations
The plot depicts the binding isotherm simulation of a 1:1 interaction of 4-[2-[4-(dimethylamino)phenyl]ethenyl]-1-[2-(4-aminophenoxy)ethyl] pyridinium bromide (0.0003179650238473768 M) and CB7 (0 — 0.0006359300476947536 M).
Please sign in: customize the simulation by signing in to the SupraBank.
