Perturbation of water-ethanol solvent structural relaxation by a bis-urea supramolecular gel and paracetamol.

IF 3.1 2区 化学 Q3 CHEMISTRY, PHYSICAL
Riccardo Morbidini, Robert M Edkins, Kirill Nemkovskiy, Gøran Nilsen, Tilo Seydel, Katharina Edkins
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Abstract

Understanding structural dynamics on the picosecond/nanometer scale in complex fluids is crucial for advancing various fields, from material chemistry to drug delivery. We employ polarized quasi-elastic neutron spectroscopy to investigate the perturbation to the hydrogen bond network of water-ethanol mixtures induced by a supramolecular gel network and by paracetamol (PCM) molecules. Interestingly, while the supramolecular gelator significantly alters the macroscopic behavior of the solvent at concentrations of 0.3 and 0.5 wt. %, it does not affect the hydrogen bond network at the microscopic level. In contrast, the addition of PCM at 5 wt. %, which does not change the macroscopic properties, modifies the structural dynamics of water-ethanol mixtures at length scales commensurate with and below the PCM-PCM correlation length in the mixture. This study reveals the intricate interplay between solute, solvent, and gel interactions, demonstrating a lack of direct correlation between macroscopic and microscopic properties in such complex systems.

双尿素超分子凝胶和扑热息痛对水-乙醇溶剂结构弛豫的扰动。
了解复杂流体在皮秒/纳米尺度上的结构动力学对于推进从材料化学到药物输送等各个领域的发展至关重要。我们采用极化准弹性中子能谱研究了超分子凝胶网络和扑热息痛(PCM)分子对水-乙醇混合物氢键网络的扰动。有趣的是,虽然超分子凝胶在浓度为0.3和0.5 wt. %时显著改变了溶剂的宏观行为,但在微观水平上并不影响氢键网络。相比之下,在5 wt. %的浓度下加入PCM,不会改变宏观性质,但会改变水-乙醇混合物的结构动力学,其长度与混合物中PCM-PCM相关长度相当或低于PCM相关长度。这项研究揭示了溶质、溶剂和凝胶相互作用之间复杂的相互作用,表明在这种复杂系统中宏观和微观性质之间缺乏直接的相关性。
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来源期刊
Journal of Chemical Physics
Journal of Chemical Physics 物理-物理:原子、分子和化学物理
CiteScore
7.40
自引率
15.90%
发文量
1615
审稿时长
2 months
期刊介绍: The Journal of Chemical Physics publishes quantitative and rigorous science of long-lasting value in methods and applications of chemical physics. The Journal also publishes brief Communications of significant new findings, Perspectives on the latest advances in the field, and Special Topic issues. The Journal focuses on innovative research in experimental and theoretical areas of chemical physics, including spectroscopy, dynamics, kinetics, statistical mechanics, and quantum mechanics. In addition, topical areas such as polymers, soft matter, materials, surfaces/interfaces, and systems of biological relevance are of increasing importance. Topical coverage includes: Theoretical Methods and Algorithms Advanced Experimental Techniques Atoms, Molecules, and Clusters Liquids, Glasses, and Crystals Surfaces, Interfaces, and Materials Polymers and Soft Matter Biological Molecules and Networks.
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