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Part 1: Document Description
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Citation |
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Title: |
Replication data of Buchmeiser group for: Reaction Mechanism of Ring-Closing Metathesis with a Cationic Molybdenum Imido Alkylidene N‑Heterocyclic Carbene Catalyst |
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Identification Number: |
doi:10.18419/darus-1714 |
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Distributor: |
DaRUS |
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Date of Distribution: |
2021-03-25 |
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Version: |
1 |
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Bibliographic Citation: |
Kesharwani, Manoj Kumar; Elser, Iris; Musso, Janis; Buchmeiser, Michael; Kästner, Johannes, 2021, "Replication data of Buchmeiser group for: Reaction Mechanism of Ring-Closing Metathesis with a Cationic Molybdenum Imido Alkylidene N‑Heterocyclic Carbene Catalyst", https://doi.org/10.18419/darus-1714, DaRUS, V1 |
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Citation |
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Title: |
Replication data of Buchmeiser group for: Reaction Mechanism of Ring-Closing Metathesis with a Cationic Molybdenum Imido Alkylidene N‑Heterocyclic Carbene Catalyst |
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Identification Number: |
doi:10.18419/darus-1714 |
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Authoring Entity: |
Kesharwani, Manoj Kumar (Universität Stuttgart) |
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Elser, Iris (Universität Stuttgart) |
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Musso, Janis (Universität Stuttgart) |
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Buchmeiser, Michael (Universität Stuttgart) |
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Kästner, Johannes (Universität Stuttgart) |
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Grant Number: |
358283783 (SFB 1333) |
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Distributor: |
DaRUS |
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Access Authority: |
Buchmeiser, Michael |
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Depositor: |
Musso, Janis |
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Date of Deposit: |
2021-03-12 |
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Holdings Information: |
https://doi.org/10.18419/darus-1714 |
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Study Scope |
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Keywords: |
Chemistry, Reaction Mechanism, Cationic Molybdenum Alkylidene NHC Complexes, Ring-Closing-Metathesis |
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Abstract: |
DFT calculations were carried out to explore all relevant pathways for the ring-closing metathesis (RCM) reaction of a cationic molybdenum imido alkylidene N-heterocyclic carbene (NHC) catalyst with α,ω-dienes.The 1H NMR spectrum of the reaction between [Mo(N-2,6-Me2-C6H3)(CHCMe2Ph)(IMes)(OCH(CF3)2)+ B(ArF)4–] and 1,7-octadiene confirms the absence of any β-H transfer. All NMR spectra of for the characterization of [Mo(N-2,6-Me2-C6H3)(CHCMe2Ph)(IMes)(OCH(CF3)2)+ B(ArF)4–] as well as the spectra of all NMR experiments discussed in the supporting information are included. Used methods and instruments (with their parameters) for the aquisition of spectra can be found in the supporting information of the paper. |
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Methodology and Processing |
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Data Access |
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Other Study Description Materials |
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Related Publications |
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Citation |
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Title: |
Kesharwani, 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 2020, 39 (17), 3146-3159. |
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Identification Number: |
10.1021/acs.organomet.0c00311 |
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Bibliographic Citation: |
Kesharwani, 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 2020, 39 (17), 3146-3159. |
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Label: |
NMR Experiments.zip |
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Notes: |
application/zip |
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Label: |
NMR Spectra of [Mo(N-2,6-Me2-C6H3)(CHCMe2Ph)(IMes)(OCH(CF3)2)+B(ArF)4-].zip |
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Notes: |
application/zip |