Parametrization of Catalytic Organic Reactions with Convex Hammett Plots

[EN] Quantification is essential to fairly compare between synthetic reactions in chemistry. Here we propose two new parameters called "adapted sensitivity constant" (rho(adap)) and "substrate electronics adaptability" (SEA), easily obtainable from Hammett plots,...

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Detalles Bibliográficos
Autores: Leyva Perez, Antonio|||0000-0003-1063-5811, Ballesteros-Soberanas, Jordi, Bilanin-Artigado, Cristina
Tipo de recurso: artículo
Fecha de publicación:2023
País:España
Institución:Universitat Politècnica de València (UPV)
Repositorio:RiuNet. Repositorio Institucional de la Universitat Politécnica de Valéncia
Idioma:inglés
OAI Identifier:oai:riunet.upv.es:10251/204523
Acceso en línea:https://riunet.upv.es/handle/10251/204523
Access Level:acceso abierto
Palabra clave:Hammett plot,catalysis
Parametrization
Organic synthesis
Substrate scope
Metal clusters
Semi-hydrogenation of alkynes
Styrene coupling
Descripción
Sumario:[EN] Quantification is essential to fairly compare between synthetic reactions in chemistry. Here we propose two new parameters called "adapted sensitivity constant" (rho(adap)) and "substrate electronics adaptability" (SEA), easily obtainable from Hammett plots, to assess the ability of a (catalytic) reaction to transform substrates with opposing electronics. These new parameters allow one to list reactions, catalyzed or not, as a function of substrate scope.