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Article 2018

Autor: Domingo, L.R. Ríos-Gutiérrez, M. Pérez, P.

The competitiveness of the BF3 Lewis acid (LA) catalyzed polar Diels–Alder (P-DA) and polar Alder-ene (P-AE) reactions of 2-methyl-1,3-butadiene, a diene possessing an allylic hydrogen, with formaldehyde has been studied within the Molecular Electron Density Theory (MEDT) at the MPWB1K/6-311G(d,p...

Enlace original: http://repositorio.unab.cl/xmlui/handle/ria/10925

Repositorio Universidad Andrés Bello
Enlace permanente

Domingo, L.R. ,  Ríos-Gutiérrez, M. ,  Pérez, P. ,  [A molecular electron density theory study of the competitiveness of polar diels–alder and polar alder-ene reactions] ,  A molecular electron density theory study of the competitiveness of polar diels–alder and polar alder-ene reactions
Article 2017

Autor: Domingo, L.R. Ríos-Gutiérrez, M. Pérez, P.

The [3 + 2] cycloaddition (32CA) reaction of C-phenyl-N-tert-butylnitrone with 1,2-cyclohexadiene (CHDE), a strained allene, has been studied within Molecular Electron Density Theory (MEDT) at the DFT B3LYP/6-311G(d,p) computational level. This non-polar 32CA reaction, which takes place through a...

Enlace original: http://repositorio.unab.cl/xmlui/handle/ria/4888

Repositorio Universidad Andrés Bello
Enlace permanente

Domingo, L.R. ,  Ríos-Gutiérrez, M. ,  Pérez, P. ,  [A molecular electron density theory study of the [3 + 2] cycloaddition reaction of nitrones with strained allenes] ,  A molecular electron density theory study of the [3 + 2] cycloaddition reaction of nitrones with strained allenes

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