Browsing by Author "Ormazábal Toledo, Rodrigo"
Now showing items 1-7 of 7
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Ormazábal Toledo, Rodrigo; Campodónico, Paola R.; Contreras Ramos, Renato (Amer Chemical Soc, 2011-02-18)It is proposed that the electrofugality of a fragment within a molecule is determined by its group nucleophilicity. The variation of electrofugality should be tightly related to the electron releasing ability of the ...
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Lodeiro, Lucas; Contreras Ramos, Renato; Ormazábal Toledo, Rodrigo (American Chemical Society, 2018)© 2018 American Chemical Society. We report on several parameters that can be used to describe the 1-ethyl-3-methyl-4,5-(X2)imidazolium cations (where X = H, Br, and I) within the Canongia-Lopez and Padua Force Field (CL&P) ...
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Ormazábal Toledo, Rodrigo; Santos, José G.; Ríos, Paulina; Castro, Enrique A.; Campodónico, Paola R.; Contreras Ramos, Renato (American Chemical Society, 2013)Preferential solvation in aromatic nucleophilic substitution reactions is discussed using a kinetic study complemented with quantum chemical calculations. The model system is the reaction of a series of secondary ...
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Campodónico, Paola R.; Ormazábal Toledo, Rodrigo; Aizman, Arie; Contreras Ramos, Renato (Elsevier, 2010)We herein report on the group electrophilicity of molecular fragments present in the title compounds to describe leaving group abilities in reactions of aryl benzoates toward CN . It is found that the presence ...
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Ormazábal Toledo, Rodrigo; Castro, Enrique A.; Santos, José G.; Millán, Daniela; Cañete, Alvaro; Contreras Ramos, Renato; Campodónico, Paola R. (2012)In nucleophilic substitution reactions at carbonyl centres, there are two possible channels. The first one occurs when the attack of nucleophilic agents takes place simultaneously with the departure of the nucleofuge. This ...
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Ormazábal Toledo, Rodrigo; Contreras, Renato (Elsevier, 2020)This review deals with the problem of designing safer solvents for chemical transformation and chemical processes. These materials generically defined as neoteric solvents include the well known ionic liquids (ILs) and ...
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Ormazábal Toledo, Rodrigo; Contreras Ramos, Renato; Tapia, Ricardo A.; Campodónico, Paola R. (2013)We herein report results obtained from an integrated experimental and theoretical study on aromatic nucleophilic substitution (SNAr) reactions of a series of amines towards 1-fluoro-2,4-dinitrobenzene in water. Specific ...