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A Model for Correlation of Various Solvatochromic Parameters with Composition in Aqueous and Organic Binary Solvent Systems
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  • A Model for Correlation of Various Solvatochromic Parameters with Composition in Aqueous and Organic Binary Solvent Systems
  • A Model for Correlation of Various Solvatochromic Parameters with Composition in Aqueous and Organic Binary Solvent Systems
저자명
Aziz. Habibi-Yangjeh
간행물명
Bulletin of the Korean Chemical Society
권/호정보
2004년|25권 8호|pp.1165-1170 (6 pages)
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대한화학회
파일정보
정기간행물|ENG|
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이 논문은 한국과학기술정보연구원과 논문 연계를 통해 무료로 제공되는 원문입니다.
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기타언어초록

The applicability of the combined nearly ideal binary solvent/Redlich-Kister (CNIBS/R-K) equation for correlation of various solvatochromic parameters (SP) with composition is shown employing 84 experimental data sets for aqueous and organic binary solvent systems at temperatures ranging 15 to $75^{circ}C$. The model provides a simple computational model to correlate/predict different SP values in various binary solvent systems. In proposed equations, $MPD_s$ (mean percentage deviations) are between 0.0500% and 6.9591% in mixtures of dimethyl sulfoxide with 2-methylpropan-2-ol and benzene with 2-methylpropan-2-ol, respectively. Correlation of the calculated and experimental values of various SP give an equation with an overall mean percentage deviation (OMPD) of 1.1900, $R^2$ = 0.99692, s.e = 0.01223 and F = 341925.51. Approximately 70% of the calculated SP values have IPD (individual percentage deviation) lower than one and it is possible to predict unmeasured SP values by using only eight experimental data.