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Manuscript title: Rationalizing the Mechanism of Peroxyformate Decomposition: Computational Insights to Understand Solvent Influence

Journal: Chem. Eur. J.

DOI: 10.1002/chem.202100755

Metadata:

Title: /Toluene TS_Py_Addition
Authors: Garay Ruiz, Diego
Keywords: peroxide decomposition
DFT
organocatalysis
implicit solvent
carbonate decomposition
peroxyformate
Issue Date: 18-Feb-2021
Publisher: Institute of Chemical Research of Catalonia
Description: TS_Py_Addition, Toluene, WB97XD/6-311G(d,p)
URI: https://iochem-bd.iciq.es/browse/handle/100/28207
Appears in Collections:Peroxyformate - DOI: 10.19061/iochem-bd-1-198



Please use this identifier to cite or link to this item: https://iochem-bd.iciq.es/browse/handle/100/28207

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