Publication data of the Simulations for: "Reaction Mechanism of Ring-Closing Metathesis with a Cationic Molybdenum Imido Alkylidene N-Heterocyclic Carbene Catalyst"https://doi.org/10.18419/darus-1161Kästner, JohannesKesharwani, Manoj KumarElser, IrisMusso, JanisBuchmeiser, MichaelDaRUS2021-04-132023-08-08T09:40:27ZAll primary data files and processed data of the calculations contributing to the journal article. The input and output files of each case are given in one directory.ChemistryKesharwani, M. K., Elser, I., Musso, J. V., Buchmeiser, M. R., & Kästner, J. “Reaction Mechanism of Ring-Closing Metathesis with a Cationic Molybdenum Imido Alkylidene N-Heterocyclic Carbene Catalyst.” Organometallics 39, 3146-3159 (2020), doi, 10.1021/acs.organomet.0c00311, https://doi.org/10.1021/acs.organomet.0c003112021-04-13Kästner, Johannes2020-11-30CC BY 4.0