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<i>Supporting data for</i> "Host-Guest Chemistry of Conformationally Flexible Molecular Cages and Catenanes"

dataset
posted on 2025-04-28, 06:02 authored by Shan He
<p dir="ltr">Conformational changes are of fundamental importance in many aspects of chemistry. In host-guest chemistry, structurally flexible hosts will be adaptive to accommodate guests of slightly different structures and result in better host-guest complementarity and strong binding affinity. While thermodynamic understanding of conformational change in host-guest system is well studied, kinetic understanding of host-guest binding is relatively limited, although it is critical for understanding the binding mechanism and selectivity. In this work, studies on two conformationally flexible cages and a series of catenanes are described, including their synthesis, kinetics and thermodynamics properties of conformational changes and applications. </p><p dir="ltr">The dataset includes Nuclear magnetic resonance data (NMR), Mass spectrometry data (MS), Ultraviolet-visible spectroscopy data (UV-vis), Fluorescence spectroscopy data (FL), Circular dichroism data (CD) and Circularly Polarized Luminescence data (CPL).</p>

Funding

National Natural Science Foundation of China (No. 22101125)

National Natural Science Foundation of China (No. 22125105)

the Shenzhen Science and Technology Innovation Committee (JCYJ20180504165810828),

the CAS-Croucher Funding Scheme for Joint Laboratories and the Collaborative Research Fund (CRF) (C7075-21G)

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