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J Phys Chem B ; 128(39): 9604-9612, 2024 Oct 03.
Artigo em Inglês | MEDLINE | ID: mdl-39302877

RESUMO

This study examines the kinetics and thermodynamics of the inclusion complex (IC) formation between sodium dodecylbenzenesulfonate (SDBS) and amine-modified ß-cyclodextrin (ßCD-NH2) using surface plasmon resonance (SPR) and theoretical analysis. We determined a binding constant of 103 L mol-1 for the thermodynamically stable complex ([ßCD-NH2/SDBS]°) within the temperature range of 285.2-301.2 K. The thermodynamic analysis revealed a transition from entropy-driven to enthalpy-driven behavior with increasing temperature. The rate constant for IC formation was approximately 102 M-1 s-1, with the residence time decreasing from 14.08 s at 285.2 K to 6.13 s at 301.2 K. We observed the formation of an activated complex ([ßCD-NH2/SDBS]‡), with energetic parameters indicating temperature dependence. At 285.2 K, the activated enthalpy change was positive, while at 301.2 K, it was negative. The dissociation energetic parameters remained temperature-independent. Additionally, increasing concentrations of the ionic liquid 1-butyl-3-methylimidazolium chloride influenced the SDBS tail's conformation and penetration into the ßCD-NH2 cavity at the activated state. These findings provide insights into the complexation mechanism and the effects of the temperature and ionic liquids on IC formation.

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