Interaction

curated

Interaction Scheme

Molecule

Cesium chloride
Cesium chloride

c = 400.0 — 422.9 µM

Host

Tmax cl
TMAX-Cl

c = 400.0 µM

Binding Properties

𝜈 Molecule 1 : 1 Host
Ka = 290.0 ± 20.0 M-1
Kd =
logKa = 2.46 ± 0.03
T 25.0 °C ≈ 298 K
Energy kJ mol-1 kcal mol-1
ΔG = -14.06 ± 0.17 -3.36 ± 0.04
Comment
The binding constant is that of the chloride anion to the host.
These are the specifications of the determination of the experimental results.
Detection Method: Direct
Assay Type: Direct Binding Assay
Technique: Nuclear Magnetic Resonance
Detailed information about the solvation.
Solvent System Single Solvent
Solvent Deuterium Oxide
Please find here information about the dataset this interaction is part of.
Citation:

B. C. Gibb, H. Ashbaugh, J. Jordan, J. T. Mague, SupraBank 2024, Buffer and Salt Effects in Aqueous Host–Guest Systems: Screening, Competitive Binding, or Both? (dataset). https://doi.org/10.34804/supra.20220422428

Link: https://doi.org/10.34804/supra.20220422428
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Please find here information about the scholarly article describing the results derived from that data.
Citation:

J. H. Jordan, H. S. Ashbaugh, J. T. Mague, B. C. Gibb, J. Am. Chem. Soc. 2021, 143, 18605–18616.

Link: https://doi.org/10.1021/jacs.1c08457
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Binding Isotherm Simulations

The plot depicts the binding isotherm simulation of a 1:1 interaction of Cesium chloride (0.06896551724137931 M) and TMAX-Cl (0 — 0.13793103448275862 M).