Supplemental Information: [Pd(NHC)(μ-Cl)Cl]2: Versatile and Highly Reactive Complexes for Cross-Coupling Reactions that Avoid Formation of Inactive Pd(I) Off-Cycle Products
dc.contributor.author
dc.date.accessioned
2021-05-10T10:01:46Z
dc.date.available
2021-05-10T10:01:46Z
dc.date.issued
2020-08-21
dc.identifier.uri
dc.description
Dades relacionades amb les figures, esquemes i taules de l'article publicat a iScience 2020, vol. 23, núm. 8, art.núm.101377. Disponible a https://doi.org/10.1016/j.isci.2020.101377
dc.description.abstract
Data related to the figures, diagrams and tables of the published article in 'iScience', 2020, 23 (8), p.101377. The archives correspond on the one hand, to a document with the complementary information of the transparent methods of figures S1-S113, schemes S1-S8 and tables S1 and S2 of the article published in 'iScience', 2020, 23 (8), p.101377 and on the other hand, a file with cartesian coordinate data and energies related to "Figure 4. DFT-Optimized Pathway (Relative Energies to Pd (0) in kcal / mol) for the Activation of Catalysts 6, 11), and 12 6 = IPr, 11 = SIPr, 12 = IPr *, [Pd (NHC) (m-Cl) Cl] 2" from the same published article mentioned above
Dades relacionades amb les figures, esquemes i taules de l'article publicat a 'iScience', 2020, 23 (8), p.101377. Els arxius corresponen d'una banda, a un document amb la informació complementària dels mètodes transparents de les figures S1-S113, esquemes S1-S8 i taules S1 i S2 de l'article publicat a 'iScience', 2020, 23 (8), p.101377 i d'altra banda, un fitxer amb dades de coordenades cartesianes i energies relacionades amb "Figure 4. DFT-Optimized Pathway (Relative Energies to Pd (0) in kcal / mol) for the Activation of Catalysts 6, 11), and 12 6 = IPr, 11 = SIPr, 12 = IPr *, [Pd (NHC) (m-Cl) Cl] 2" del mateix article publicat abans esmenta
dc.format.mimetype
application/vnd.ms-excel
application/pdf
dc.language.iso
eng
dc.publisher
Elsevier
dc.relation
Zhou, T.; Ma, S.; Nahra, F.; Obled, A.M.C.; Poater Teixidor, A.; Cavallo, L.; Cazin, C.S. J.; Nolan, S.P.; Szostak, M. [Pd(NHC)(μ-Cl)Cl]2: Versatile and Highly Reactive Complexes for Cross-Coupling Reactions that Avoid Formation of Inactive Pd(I) Off-Cycle Products, published in 'iScience', 2020, 23 (8): 101377. https://doi.org/10.1016/j.isci.2020.101377, http://hdl.handle.net/10256/19453
dc.relation.ispartofseries
Dades de recerca
dc.relation.isreferencedby
dc.relation.uri
dc.rights
Attribution 4.0 International
dc.rights.uri
dc.subject
dc.title
Supplemental Information: [Pd(NHC)(μ-Cl)Cl]2: Versatile and Highly Reactive Complexes for Cross-Coupling Reactions that Avoid Formation of Inactive Pd(I) Off-Cycle Products
dc.type
Dataset
info:eu-repo/semantics/other
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/
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