Estimation of van der Waals interactions between solute and solvent molecules from IR spectra

Solomonov BN; Varfolomeev MA; Klimovitskii AE; Novikov VB

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Estimation of van der Waals interactions between solute and solvent molecules from IR spectra

机译：从红外光谱估算溶质与溶剂分子之间的范德华相互作用

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The influence of medium on methanol stretching OH-vibration shifts was studied in several proton acceptor solvents. A new solvent parameter that well described the influence of the medium on frequency shifts was suggested. The influence of the medium on S=O, P=O, C=O, and N=O stretching vibration shifts was analyzed. A method for estimating stretching vibration frequencies in the gas phase from data on solutions was suggested.

机译：在几种质子受体溶剂中研究了介质对甲醇拉伸OH振动位移的影响。提出了一个新的溶剂参数，该参数很好地描述了介质对频移的影响。分析了介质对S = O，P = O，C = O和N = O拉伸振动位移的影响。提出了一种根据溶液数据估算气相拉伸振动频率的方法。

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来源
《Russian Journal of Physical Chemistry》 |2005年第7期|共4页
作者
Solomonov BN; Varfolomeev MA; Klimovitskii AE; Novikov VB;
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正文语种 eng
中图分类物理化学（理论化学）、化学物理学;
关键词
SOLVATION; ENTHALPY; COOPERATIVITY; PARAMETERS; BONDS;

机译：溶剂化;焓;合作性;参数;键;

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1. Estimation of van der Waals interactions between solute and solvent molecules from IR spectra [J] . Solomonov BN, Varfolomeev MA, Klimovitskii AE, Russian Journal of Physical Chemistry . 2005,第7期

机译：从红外光谱估算溶质与溶剂分子之间的范德华相互作用
2. Contributions of solvent-solvent hydrogen bonding and van der Waals interactions to the attraction between methane molecules in water. [J] . Rank JA, Baker D Biophysical Chemistry: An International Journal Devoted to the Physical Chemistry of Biological Phenomena . 1998,第2a3期

机译：溶剂-溶剂氢键和范德华相互作用对水中甲烷分子之间的吸引力的贡献。
3. Van der Waals interactions in a monosolvated chiral fluorinated molecule: R2PI vibroelectronic spectra of (R)-1-phenyl-2,2,2-trifluoroethanol clustered with water [J] . Giardini A, Rondino F, Cattenacci G, Chemical Physics Letters . 2007,第4a6期

机译：单溶剂化手性氟化分子中的范德华相互作用：（R）-1-苯基-2,2,2-三氟乙醇与水团簇的R2PI振动电子光谱
4. Isolation and spectral properties of Kr@C_60, a stable van der waals molecule [C] . K. Yamamoto, M. Saunders, A. Khong, International Symposium on Fullerenes 2000 - Vol.10 Chemistry and Physics of Fullerenes and Carbon Nanomaterials 197~th Meeting of the Electrochemical Society in Toronto, Canada, May 14-18, 2000 . 2000

机译：稳定的范德华分子Kr @ C_60的分离和光谱性质
5. Virus Attachment to Surfaces: Assessing Relative Contributions of Electrostatic, Van Der Waals, and Acid-base Interactions [D] . Dang, Hien Thi Thu. 2018

机译：病毒附件到表面：评估静电，范德华和酸碱相互作用的相对贡献
6. Spectral mixing formulations for van der Waals–London dispersion interactions between multicomponent carbon nanotubes [O] . Rick Rajter, Roger H. French, Rudi Podgornik, -1

机译：多组分碳纳米管之间范德华-伦敦色散相互作用的光谱混合配方
7. Molecular versus van der Waals-like Surfaces: Revisiting The Choice Of Solute-solvent Boundary Definition In Implicit Solvent [O] . Chen Jianhan 2009

机译：分子与范德华样表面：重新探讨隐式溶剂中溶剂边界定义的选择
8. Van Der Waals Modes of Solute/Solvent Clusters: Benzene-Methane, -Deuteromethane, and -Carbon Tetrafluoride. [R] . Menapace, J. A., Bernstein, E. R. 1987

机译：范德瓦尔斯溶质/溶剂团簇的模式：苯 - 甲烷， - 十氟甲烷和 - 四氟化碳。

Estimation of van der Waals interactions between solute and solvent molecules from IR spectra

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