Density Functional Study on Activation of ortho-CH Bond in Aromatic Ketone by Ru Complex. Role of Unusual Five-Coordinated d6 Metallacycle Intermediate with Agostic Interaction
- 19 November 1998
- journal article
- Published by American Chemical Society (ACS) in Journal of the American Chemical Society
- Vol. 120 (48), 12692-12693
- https://doi.org/10.1021/ja9816943
Abstract
No abstract availableThis publication has 15 references indexed in Scilit:
- Catalytic addition of CH bonds to multiple bondsPure and Applied Chemistry, 1997
- Ultrafast reductive elimination of hydrogen from a metal carbonyl dihydride complex; a study by time-resolved IR and visible spectroscopyJ. Chem. Soc., Dalton Trans., 1997
- Catalytic Addition of Aromatic Carbon–Hydrogen Bonds to Olefins with the Aid of Ruthenium ComplexesBulletin of the Chemical Society of Japan, 1995
- Catalytic C-H/olefin couplingPure and Applied Chemistry, 1994
- Efficient catalytic addition of aromatic carbon-hydrogen bonds to olefinsNature, 1993
- Density-functional thermochemistry. III. The role of exact exchangeThe Journal of Chemical Physics, 1993
- Ab initio effective core potentials for molecular calculations. Potentials for K to Au including the outermost core orbitalsThe Journal of Chemical Physics, 1985
- Self-consistent molecular-orbital methods. 22. Small split-valence basis sets for second-row elementsJournal of the American Chemical Society, 1982
- Self-consistent molecular orbital methods. 21. Small split-valence basis sets for first-row elementsJournal of the American Chemical Society, 1980
- Self—Consistent Molecular Orbital Methods. XII. Further Extensions of Gaussian—Type Basis Sets for Use in Molecular Orbital Studies of Organic MoleculesThe Journal of Chemical Physics, 1972