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QSPR analysis of infinite dilution activity coefficients of chlorinated organic compounds in water

✍ Scribed by Jie Xu; Hui Zhang; Luoxin Wang; Wenxiang Ye; Weilin Xu; Zengchang Li

Book ID
108132430
Publisher
Elsevier Science
Year
2010
Tongue
English
Weight
308 KB
Volume
291
Category
Article
ISSN
0378-3812

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πŸ“œ SIMILAR VOLUMES

Prediction of infinite dilution activity
Prediction of infinite dilution activity coefficients of chlorinated organic compounds in aqueous solution from quantum-chemical descriptors
✍ Eduardo J. Delgado; Joel B. Alderete πŸ“‚ Article πŸ“… 2001 πŸ› John Wiley and Sons 🌐 English βš– 98 KB

## Abstract A quantitative structure–property relationship (QSPR) model is developed to correlate the natural logarithm of infinite dilution activity coefficients, ln (Ξ³^∞^), of 45 chlorinated organic compounds in aqueous solution from quantum‐chemical descriptors. The best correlation equation con