Solvatochromic parameters for binary mixtures of 1-(1-butyl)-3-methylimidazolium tetrafluoroborate with some protic molecular solvents

被引:86
作者
Harifi-Mood, AR
Habibi-Yangjeh, A
Gholami, MR [1 ]
机构
[1] Sharif Univ Technol, Dept Chem, Tehran, Iran
[2] Univ Mohaghegh Ardebili, Fac Sci, Dept Chem, Ardebil, Iran
关键词
D O I
10.1021/jp0602373
中图分类号
O64 [物理化学(理论化学)、化学物理学];
学科分类号
070304 ; 081704 ;
摘要
The solvatochromic parameters (E-T(N) normalized polarity parameter; j-r*, dipolarity/polarizability; beta, hydrogen-bond acceptor basicity; alpha, hydrogen-bond donor acidity) were determined for binary solvent mixtures of 1-(1-butyl)-3-methylimidazolium tetrafluoroborate ([bmim]BF4) with water, methanol, and ethanol at 25 degrees C over the whole range of mole fractions. In nonaqueous solutions, the E-T(N) value of the mixture increases with mole the fraction of [bmim]BF4 and then decreases gradually to the value of pure [bmim]BF4. Positive deviation from ideal behavior was observed for the solvent parameters E-T(N), pi*, and alpha, whereas the deviation of the parameter is negative. The applicability of the combined nearly ideal binary solvent/Redlich-Kister equation for the con-elation of various solvatochromic parameters with solvent composition was proved too for the first time. This equation provides a simple computational model to correlate and/or predict various solvatochromic parameters for many binary solvent systems. The correlation between the calculated and the experimental values of various parameters was in accordance with this model. Solute-solvent and solvent-solvent interactions have been applied for interpretation of the results.
引用
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页码:7073 / 7078
页数:6
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