Reaction of nitrones with silyl ketene acetals : a DFT study
Copyright 2005 Wiley Periodicals, Inc.
| Veröffentlicht in: | Journal of computational chemistry. - 1984. - 27(2006), 2 vom: 30. Jan., Seite 157-62 |
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| Weitere Verfasser: | , |
| Format: | Aufsatz |
| Sprache: | English |
| Veröffentlicht: |
2006
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| Zugriff auf das übergeordnete Werk: | Journal of computational chemistry |
| Schlagworte: | Journal Article Research Support, Non-U.S. Gov't Acetals Ethylenes Ketones Nitrogen Oxides Organometallic Compounds Silanes nitrones ketene |
| Zusammenfassung: | Copyright 2005 Wiley Periodicals, Inc. Theoretical calculations at the DFT level indicate that the reaction of a nitrone with a silyl ketene acetal proceeds, contrary to previous suggestions, through a classical 1,3-dipolar cycloaddition, followed by a silyl group transfer step to give the open-chain product. Introduction of a diffuse basis set is necessary to describe properly nitrones. The influence of a Lewis acid has been studied |
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| Beschreibung: | Date Completed 19.04.2006 Date Revised 15.11.2012 published: Print Citation Status MEDLINE |
| ISSN: | 1096-987X |