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Theoretical study on the molecular mechanism of the [5 + 2] vs. [4 + 2] cyclization mediated by Lewis acid in the quinone system

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Theoretical study on the molecular mechanism of the [5 + 2] vs. [4 + 2] cyclization mediated by Lewis acid in the quinone system

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Soto-Delgado, J.; Sáez-Cases, JA.; Tapia, RA.; Domingo, LR. (2013). Theoretical study on the molecular mechanism of the [5 + 2] vs. [4 + 2] cyclization mediated by Lewis acid in the quinone system. Organic and Biomolecular Chemistry. 11(48):8357-8365. doi:10.1039/c3ob41860j

Por favor, use este identificador para citar o enlazar este ítem: http://hdl.handle.net/10251/85252

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Title: Theoretical study on the molecular mechanism of the [5 + 2] vs. [4 + 2] cyclization mediated by Lewis acid in the quinone system
Author: Soto-Delgado, Jorge Sáez-Cases, José Antonio Tapia, Ricardo A. Domingo, Luis R.
UPV Unit: Universitat Politècnica de València. Instituto Universitario Mixto de Tecnología Química - Institut Universitari Mixt de Tecnologia Química
Issued date:
Abstract:
[EN] The thermal and Lewis acid (LA) catalyzed cyclizations of quinone 1 involved in the synthesis of Colombiasin A and Elipsaterosin B have been theoretically studied using DFT methods at the B3LYP/6-311G(d,p) computational ...[+]
Subjects: Electron localization function , Polarizable continuum model , Diels-alder reaction , Topological analysis , Bond formation , Elf analysis , Cycloaddition reaction , (-) Elisapterosin-B , (-) Colombiasin-A
Copyrigths: Reserva de todos los derechos
Source:
Organic and Biomolecular Chemistry. (issn: 1477-0520 ) (eissn: 1477-0539 )
DOI: 10.1039/c3ob41860j
Publisher:
Royal Society of Chemistry
Publisher version: http://doi.org/10.1039/c3ob41860j
Thanks:
This work was supported by the Post-Doctoral fellow FONDECYT Grant 3130359 and Project ICM-P10-003-F CILIS granted by Fondo de Innovacion para la Competitividad del Ministerio de Economia, Fomento y Turismo, Chile.
Type: Artículo

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