DUGiDocsMechanistic Aspects of the Palladium-Catalyzed Suzuki-Miyaura Cross-Coupling Reaction
dc.contributor.author
dc.date.accessioned
2022-01-21T10:43:17Z
dc.date.available
2022-01-21T10:43:17Z
dc.date.issued
2021-09-24
dc.identifier.issn
0947-6539
dc.identifier.uri
dc.description.abstract
The story of C−C bond formation includes several reactions, and surely Suzuki-Miyaura is among the most outstanding ones. Herein, a brief historical overview of insights regarding the reaction mechanism is provided. In particular, the formation of the catalytically active species is probably the main concern, thus the preactivation is in competition with, or even assumes the role of the rate determining step (rds) of the overall reaction. Computational chemistry is key in identifying the rds and thus leading to milder conditions on an experimental level by means of predictive catalysis
dc.description.sponsorship
A.P is grateful to the Ministerio de
Economía y Competitividad (MINECO) of Spain for project
PGC2018-097722-B I00, the Generalitat de Catalunya for project
2017SGR39, Xarxa de Referència en Química Teórica i Computacional). A.P. thanks the ICREA Academia prize 2019. SPN thanks
the iBOF (C3 project) for partial support of the work performed
in Ghent. The Research Foundation – Flanders (FWO) is also
gratefully acknowledged for a Fundamental Research PhD
fellowship to NVT (11I6921N)
Open Access funding provided thanks to the CRUE-CSIC agreement with Wiley
dc.format.mimetype
application/pdf
dc.language.iso
eng
dc.publisher
Wiley
dc.relation
PGC2018-097722-B-I00
dc.relation.isformatof
Reproducció digital del document publicat a: https://doi.org/10.1002/chem.202101880
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Chemistry - A European Journal, 2021, vol. 27, núm. 54, p. 13481-13493
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Articles publicats (D-Q)
dc.rights
Attribution 4.0 International
dc.rights.uri
dc.subject
dc.title
Mechanistic Aspects of the Palladium-Catalyzed Suzuki-Miyaura Cross-Coupling Reaction
dc.type
info:eu-repo/semantics/article
dc.rights.accessRights
info:eu-repo/semantics/openAccess
dc.relation.projectID
info:eu-repo/grantAgreement/AEI/Plan Estatal de Investigación Científica y Técnica y de Innovación 2017-2020/PGC2018-097722-B-I00/ES/REDESCUBRIMIENTO IN SILICO DE MECANISMOS ASISTIDOS DUALES DE LA CATALISIS MONOMETALICA: HACIA EL TRABAJO EN CONDICIONES SUAVES/
dc.type.version
info:eu-repo/semantics/publishedVersion
dc.identifier.doi
dc.identifier.idgrec
034912
dc.contributor.funder
dc.type.peerreviewed
peer-reviewed
dc.relation.FundingProgramme
dc.relation.ProjectAcronym
dc.identifier.eissn
1521-3765