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疏水醇链长度对水的氢键网络的影响。

Effect of the hydrophobic alcohol chain length on the hydrogen-bond network of water.

作者信息

Juurinen Iina, Pylkkänen Tuomas, Sahle Christoph J, Simonelli Laura, Hämäläinen Keijo, Huotari Simo, Hakala Mikko

机构信息

Department of Physics, P.O.B. 64, FI-00014 University of Helsinki , Helsinki, Finland.

出版信息

J Phys Chem B. 2014 Jul 24;118(29):8750-5. doi: 10.1021/jp5045332. Epub 2014 Jul 9.

Abstract

The microscopic structure of the hydrogen-bond network of water-alcohol mixtures was studied using X-ray Raman scattering (XRS). To systematically examine how the hydrogen-bond network of water is affected by an increasing size of the hydrophobic group, small linear alcohols (methanol, ethanol, and propanol) in constant mole fractions were studied. The oxygen K-edge spectra were not altered upon hydration of the alcohols beyond a simple superposition of signals from alcohol and water. The experiment thus indicates that alcohols do not have a substantial effect on the structure of the hydrogen-bond network of water. In particular, no apparent breaking or forming of the hydrogen bonds is observed to take place in the overall structure. In addition, there is no indication of changes in the tetrahedrality of the hydrogen-bond network of water in the vicinity of alcohol molecules.

摘要

利用X射线拉曼散射(XRS)研究了水 - 醇混合物氢键网络的微观结构。为了系统地研究水的氢键网络如何受到疏水基团尺寸增加的影响,研究了恒定摩尔分数下的小分子线性醇(甲醇、乙醇和丙醇)。醇水合后,氧K边光谱除了来自醇和水的信号简单叠加外没有改变。因此,该实验表明醇对水的氢键网络结构没有实质性影响。特别是,在整体结构中未观察到氢键有明显的断裂或形成。此外,没有迹象表明在醇分子附近水的氢键网络的四面体结构发生变化。

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