Computational Characterization of the Mechanism for the Oxidative Coupling of Benzoic Acid and Alkynes by Rhodium/Copper and Rhodium/Silver Systems
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Please use this identifier to cite or link to this collection:doi:10.19061/iochem-bd-1-73
Please use this identifier to cite or link to this collection:doi:10.19061/iochem-bd-1-73
This dataset derived results are published in:
Manuscript title: Computational Characterization of the Mechanism for the Oxidative Coupling of Benzoic Acid and Alkynes by Rhodium/Copper and Rhodium/Silver Systems
Journal: Chem. Eur. J.
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Subject
Basis
- 59 6-311++G**
- 4 6-31G*
- 4 LANL2DZ
Stoichiometry
Program name
- 63 Gaussian
Calculation type
Institution