A Solvent Effect in Alkoxy Radical Decomposition

1962 ◽  
Vol 84 (14) ◽  
pp. 2845-2846 ◽  
Author(s):  
Cheves. Walling ◽  
Albert. Padwa
Keyword(s):  
Solvent Effect ◽  
Alkoxy Radical ◽  
Radical Decomposition

Kinetic Solvent Effects in Organic Reactions

2017 ◽  
Author(s):  
Belinda Slakman ◽  
Richard West
Keyword(s):  
Solvent Effect ◽  
Reaction Kinetics ◽  
Computational Methods ◽  
High Throughput ◽  
Kinetic Modeling ◽  
Solvent Effects ◽  
Reaction Rates ◽  
Prior Work ◽  
Solvent Phase ◽  
High Throughput Manner

<div> <div> <div> <p>This article reviews prior work studying reaction kinetics in solution, with the goal of using this information to improve detailed kinetic modeling in the solvent phase. Both experimental and computational methods for calculating reaction rates in liquids are reviewed. Previous studies, which used such methods to determine solvent effects, are then analyzed based on reaction family. Many of these studies correlate kinetic solvent effect with one or more solvent parameters or properties of reacting species, but it is not always possible, and investigations are usually done on too few reactions and solvents to truly generalize. From these studies, we present suggestions on how best to use data to generalize solvent effects for many different reaction types in a high throughput manner. </p> </div> </div> </div>

Isotope solvent effect on the hydrogenation of maleic acid

1978 ◽  
Vol 43 (7) ◽  
pp. 1832-1837
Author(s):  
Rostislav Kudláček ◽  
Josef Cabicar ◽  
Milan Buňata
Keyword(s):  
Solvent Effect ◽  
Maleic Acid

Solvent effect on valence vibration of NH bond of acetanilides and phenylcarbamates

1976 ◽  
Vol 41 (2) ◽  
pp. 430-432
Author(s):  
V. Bekárek ◽  
J. Jirkovský ◽  
K. Pragerová ◽  
J. Socha
Keyword(s):  
Solvent Effect ◽  
Valence Vibration

Additive-multiplicative description of extrathermodynamic relations: Application to solvent effect

1990 ◽  
Vol 55 (3) ◽  
pp. 634-643 ◽  
Author(s):  
Oldřich Pytela
Keyword(s):  
Solvent Effect ◽  
Additive Model ◽  
Multiplicative Model ◽  
Data Matrix ◽  
Statistical Parameters ◽  
Model Application ◽  
Mutual Correlation ◽  
Linear Free Energy ◽  
Cross Terms ◽  
Energy Relationships

The paper is focused on evaluation of significance of the additive-multiplicative model of extrathermodynamic relations (linear free energy relationships) as compared with the additive model. Application of the method of conjugated deviations to a data matrix describing manifestations of solvent effects in 367 processes in solutions (6 334 data) has shown that introduction of cross-terms into the additive model is statistically significant for a model with two and particularly three parameters. At the same time the calculation has provided a new set of statistical parameters for description of solvent effect with application of the additive-multiplicative model. Compared with an analogous set designated for the additive model, the new parameters show a lower mutual correlation, retaining the same nature of the properties described, i.e. polarity-acidity (PAC parameter), polarity-basicity (PBC), and polarity-polarizability (PPC).

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