Interaction Scheme
Molecule
1-pyrenebutyric acid sodium salt
Host
Perylene-Bridged Bis(b-cyclodextrin)
Binding Properties
| 𝜈 | Molecule 1 : 1 Host | ||
| Ka = | 4.30⋅104 | M-1 | |
| Kd = | |||
| logKa = | |||
| T | 25.0 °C | ||
| Energy | kJ mol-1 | kcal mol-1 | |||
|---|---|---|---|---|---|
| ΔG | = | -26.45 | -6.32 |
These are the specifications of the determination of the experimental results.
| Detection Method: | Direct | |||
| Assay Type: | Direct Binding Assay | |||
| Technique: | Absorbance | |||
| 𝛌abs | = | 497.0 nm | ||
Detailed information about the solvation.
| Solvent System | Buffer System | 50 mM phosphate pH-8.67 |
| Solvents | water | |
| Additives | phosphate | |
| Source of Concentration | estimated | |
| Total concentration | 50.0 mM | |
| pH | 8.67 |
Please find here information about the dataset this interaction is part of.
| Citation: |
D. Guo, Y. Liu, K. Wang, B. Jiang, Z. Sun, SupraBank 2024, Molecular Aggregation Behavior of Perylene-Bridged Bis(β-cyclodextrin) and Its Electronic Interactions upon Selective Binding with Aromatic Guests (dataset). https://doi.org/10.34804/supra.2021092838 |
| Link: | https://doi.org/10.34804/supra.2021092838 |
| Export: | BibTex | RIS | EndNote |
Please find here information about the scholarly article describing the results derived from that data.
| Citation: |
K.-R. Wang, D.-S. Guo, B.-P. Jiang, Z.-H. Sun, Y. Liu, J. Phys. Chem. B 2009, 114, 101–106. |
| Link: | https://doi.org/10.1021/jp908699b |
| Export: | BibTex | RIS | EndNote | |
Binding Isotherm Simulations
The plot depicts the binding isotherm simulation of a 1:1 interaction of 1-pyrenebutyric acid sodium salt (0.00046511627906976747 M) and Perylene-Bridged Bis(b-cyclodextrin) (0 — 0.0009302325581395349 M).
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