Dipole moment and conformation of CnH2n+1O(CH 2CH2O)mH investigated by the measurements of permittivity and FT-IR spectra in heptane solutions and by Ab initio calculations

被引：0

作者：

El-Hefnawy, Mohamed ^{[1
]}

Sameshima, Kaori ^{[1
]}

Matsushita, Toshio ^{[1
]}

Tanaka, Reiji ^{[1
]}

机构：

[1] Department of Chemistry, Graduate School of Science, Osaka City University, 3-3-138 Sugimoto, Sumiyoshi-ku, Osaka 558-8585

来源：

Bulletin of the Chemical Society of Japan | 2006年 / 79卷 / 06期

关键词：

The apparent dipole moments (μ) of 2-methoxyethanol (C1E 1); 2-ethoxyethanol; (C2E1); 2-(2-methoxyethoxy)-ethanol; (C1E2); and 2-(2-ethoxyethoxy)ethanol (C2E2) were determined in heptane solutions for the mole fraction range of 0 1E 1 were predicted by ab initio calculations. In order to compare the calculated results with experimental; a statistical calculation was performed. The calculated conformers of the isolated molecules correlated well with the experimental results of the dipole moment and the IR spectra. © 2006 The Chemical Society of Japan;

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摘要：

Journal article (JA)

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页码：845 / 856