The Acetate Proton Shuttle between Mutually Trans Ligands
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The original dataset source can be reviewed here
Please use this identifier to cite or link to this collection:doi:10.19061/iochem-bd-1-89
Please use this identifier to cite or link to this collection:doi:10.19061/iochem-bd-1-89
This dataset derived results are published in:
Manuscript title: The Acetate Proton Shuttle between Mutually Trans Ligands
Journal: Organometallics
View as
- ROOT
- Ru-PMe-OAc-Cl
- Ru-iPr-Cl-First_Reaction-BSSE
- Ru-iPr-Cl-Second_Reaction-BSSE
- Ru-iPr-OAc-First_Reaction-BSSE
- Ru-iPr-OAc-Second_Reaction-BSSE
Discover
Method
- 51 RwB97XD
Basis
- 48 SDD
- 27 6-311++g**
- 24 6-31+g*
Stoichiometry
Program name
- 51 Gaussian
Calculation type
Institution