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DFT Studies on Gold-Catalyzed Cycloisomerization of 1,5-Enynes
- Source :
- Organometallics. 31:4221-4227
- Publication Year :
- 2012
- Publisher :
- American Chemical Society (ACS), 2012.
-
Abstract
- Gold-catalyzed cycloisomerization of 1,5-enynes has been investigated with the aid of density functional theory calculations at the B3LYP level of theory. We have examined how substituents influence the reaction paths in the cycloisomerization of 1,5-enynes catalyzed by both AuCl and [AuL]+ (L = phosphine).
Details
- ISSN :
- 15206041 and 02767333
- Volume :
- 31
- Database :
- OpenAIRE
- Journal :
- Organometallics
- Accession number :
- edsair.doi...........2333be41e98c9c9a0e7f5db34798d693
- Full Text :
- https://doi.org/10.1021/om300167u