beta_H_elimination_NHC_vs_CAAC
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This dataset derived results are published in:
Manuscript title: The Janus face of high trans-effect carbenes in olefin metathesis: Gateway to both productivity and decomposition.
Journal: Chem. Sci.
DOI: 10.1039/D2SC00855F
View as
- ROOT
- GeomOpt_PBEPBE
- SP_M06L_GD3_CHCl3
- SP_PBEPBE_GD3MBJ_CHCl3
Discover
Subject
- 276 Metathesis
- 276 Olefin metathesis
Basis
- 99 GENECP
- 98 GEN
- 79 GENECP GEN
Stoichiometry
Program name
- 276 Gaussian
Calculation type
Institution