关于富含八醇的水性n-八醇混合物中的水的双重行为:X射线散射和计算机模拟研究
Martina Požar1, Jennifer Bolle2, Susanne Dogan-Surmeier2
1Faculty of Science, University of Split, Ru era Boškovic'a 33, 21000 Split, Croatia. christian.sternemann@tu-dortmund.de.
Physical chemistry chemical physics : PCCP
|January 16, 2024
概括
水水水水水,这是一个很好的方法.
科学领域:
- 物理化学 物理化学
- 材料科学 材料科学 材料科学
背景情况:
- 之前的研究表明,基分支阻碍了水合醇混合物中基组链集群的形成.
- 了解水在这些结构中的作用对于混合物特性至关重要.
研究的目的:
- 为了研究水对n-octanol混合物的结构影响,具有不同的尾分支.
- 阐明水在基团链聚合和水合中的作用.
主要方法:
- 在水性n-octanol混合物上进行X射线散射实验.
- 混合物结构和水分子相互作用的计算机模拟.
- 分析散射高峰前的位置和振幅,以推断集群大小和密度.
主要成果:
- 水分子与1-octanol与分支的八醇中的基链的相互作用不同.
- X射线散射表明水后集群大小增加,通过模拟证实了这一点.
- 峰值前的振幅趋势显示,水在1-octanol中断链,但在分支的八度醇中插入链.
结论:
- 水在n-octanol聚合中的作用取决于尾分支.
- 在1-octanol中,水破坏了大型基链;在分支的八度醇中,它增强了聚合.
- 水在小集群中起到结构强制的作用,在中等集群中起到破坏性的作用,在较大的集群中,其作用取决于大小.
更多相关视频
11:27Studying Soft-matter and Biological Systems over a Wide Length-scale from Nanometer and Micrometer Sizes at the Small-angle Neutron Diffractometer KWS-2
Published on: December 8, 2016
12.3K
09:32A New Straightforward Method for Lipophilicity logP Measurement using 19F NMR Spectroscopy
Published on: January 30, 2019
14.4K
相关概念视频
Intermolecular Forces and Physical Properties
20.8K
20.8K
Entropy and Solvation
7.1K
The process of surrounding a solute with solvent is called solvation. It involves evenly distributing the solute within the solvent. The rule of thumb for determining a solvent for a given compound is that like dissolves like. A good solvent has molecular characteristics similar to those of the compound to be dissolved. For example, polar solutions dissolve polar solutes, and apolar solvents dissolve apolar solutes. A polar solvent is a solvent that has a high dielectric constant (ϵ...
7.1K
Solubility Equilibria: Ionic Product of Water
1.0K
Pure water is a weak electrolyte; only a small amount ionizes into hydrogen and hydroxide ions. At any given temperature, the concentration of undissociated water is almost constant, so the ionic product of water is the product of the hydrogen and hydroxide ion concentrations, denoted as Kw. The square root of Kw gives the individual ion concentrations.
The ionic product of water varies with temperature, and its value is 1.0 x 10−14 at standard experimental conditions. Per Le...
The ionic product of water varies with temperature, and its value is 1.0 x 10−14 at standard experimental conditions. Per Le...
1.0K
Intermolecular Forces
58.3K
Atoms and molecules interact through bonds (or forces): intramolecular and intermolecular. The forces are electrostatic as they arise from interactions (attractive or repulsive) between charged species (permanent, partial, or temporary charges) and exist with varying strengths between ions, polar, nonpolar, and neutral molecules. The different types of intermolecular forces are ion–dipole, dipole–dipole, hydrogen bonds, and dispersion; among these, dipole–dipole, hydrogen...
58.3K
Solubility
17.5K
Solution, Solubility, and Solubility Equilibrium
A solution is a homogeneous mixture composed of a solvent, the major component, and a solute, the minor component. The physical state of a solution—solid, liquid, or gas—is typically the same as that of the solvent. Solute concentrations are often described with qualitative terms such as dilute (of relatively low concentration) and concentrated (of relatively high concentration).
In a solution, the solute particles (molecules,...
A solution is a homogeneous mixture composed of a solvent, the major component, and a solute, the minor component. The physical state of a solution—solid, liquid, or gas—is typically the same as that of the solvent. Solute concentrations are often described with qualitative terms such as dilute (of relatively low concentration) and concentrated (of relatively high concentration).
In a solution, the solute particles (molecules,...
17.5K
Physical Properties Affecting Solubility
22.7K
Solutions of Gases in Liquids
As for any solution, the solubility of a gas in a liquid is affected by the attractive intermolecular forces between solute and solvent species. Unlike solid and liquid solutes, however, there is no solute-solute intermolecular attraction to overcome when a gaseous solute dissolves in a liquid solvent since the atoms or molecules comprising a gas are far separated and experience negligible interactions. Consequently, solute-solvent interactions are the sole...
As for any solution, the solubility of a gas in a liquid is affected by the attractive intermolecular forces between solute and solvent species. Unlike solid and liquid solutes, however, there is no solute-solute intermolecular attraction to overcome when a gaseous solute dissolves in a liquid solvent since the atoms or molecules comprising a gas are far separated and experience negligible interactions. Consequently, solute-solvent interactions are the sole...
22.7K
