Bond fukui functions as descriptor of the electron density reorganization in π conjugated systems

M. Gonzalez-Suarez; Arie Aizman; Jorge Soto-Delgado; R. Contreras

doi:10.1021/jo201465g

Bond fukui functions as descriptor of the electron density reorganization in π conjugated systems

M. Gonzalez-Suarez, Arie Aizman, Jorge Soto-Delgado, R. Contreras

Facultad Ciencias Exactas

Producción científica: Contribución a una revista › Artículo › revisión exhaustiva

14 Citas (Scopus)

Resumen

The bond Fukui function is introduced and tested as a new reactivity index capable of predicting the evolution of bond breaking and formation processes during an organic reaction involving π conjugated systems. As an illustration, we examine many cases where substituted ethylenes and dienes may respond to different reagents to yield cycloaddition, Michael addition, and other reactions at double bonds.

Idioma original	Inglés
Páginas (desde-hasta)	90-95
Número de páginas	6
Publicación	Journal of Organic Chemistry
Volumen	77
N.º	1
DOI	https://doi.org/10.1021/jo201465g
Estado	Publicada - 6 ene. 2012

Áreas temáticas de ASJC Scopus

Química orgánica

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10.1021/jo201465g

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abstract = "The bond Fukui function is introduced and tested as a new reactivity index capable of predicting the evolution of bond breaking and formation processes during an organic reaction involving π conjugated systems. As an illustration, we examine many cases where substituted ethylenes and dienes may respond to different reagents to yield cycloaddition, Michael addition, and other reactions at double bonds.",

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AU - Gonzalez-Suarez, M.

AU - Aizman, Arie

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AU - Contreras, R.

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AB - The bond Fukui function is introduced and tested as a new reactivity index capable of predicting the evolution of bond breaking and formation processes during an organic reaction involving π conjugated systems. As an illustration, we examine many cases where substituted ethylenes and dienes may respond to different reagents to yield cycloaddition, Michael addition, and other reactions at double bonds.

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Bond fukui functions as descriptor of the electron density reorganization in π conjugated systems

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