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Manuscript title: The Diverse Mechanisms for the Oxidative Addition of C-Br bonds to Pd(PR3) and Pd(PR3)2 Complexes

Journal: J. Chem. Soc., Dalton Trans.

DOI: 10.1039/C9DT03155C

Full metadata record
DC FieldValueLanguage
dc.contributor.authorBesora, Maria-
dc.date.accessioned2019-10-03T10:28:57Z-
dc.date.available2019-10-03T10:28:57Z-
dc.date.created2019-10-03T12:28:55.504+02:00-
dc.date.issued2019-10-03T12:28:55.504+02:00-
dc.identifier.urihttps://iochem-bd.iciq.es/browse/handle/100/21436-
dc.descriptionthf_set_Brpdpme32-
dc.publisherInstitute of Chemical Research of Catalonia-
dc.relationOriginal title: The Diverse Mechanisms for the Oxidative Addition of C-Br bonds to Pd(PR3) and Pd(PR3)2 Complexes DOI: 10.1039/C9DT03155C Journal: J. Chem. Soc., Dalton Trans.-
dc.relation.ispartofhttp://dx.doi.org/10.19061/iochem-bd-1-138-
dc.relation.urihttp://dx.doi.org/10.1039/C9DT03155C-
dc.rightsCC BY 4.0 (c) Institute of Chemical Research of Catalonia, 2019-
dc.rights.urihttp://creativecommons.org/licenses/by/4.0/-
dc.titlethf_set_Brpdpme32-
dc.typedataset-
dc.date.updated2019-10-03T10:28:56Z-
cml.program.nameGaussianen
cml.program.version09en
cml.program.otherEM64L-G09RevD.01en
cml.methodUB3LYPen
cml.basisset6-31+G(D,P) SDD GENen
cml.multiplicity2en
cml.spintypeUnrestricteden
cml.shelltypeopenen
cml.charge0en
cml.energy.value-3621.69453082en
cml.energy.unitsEhen
cml.formula.genericC6H18BrP2Pden
cml.calculationtypeGeometry optimization Minimumen
cml.hassolventtrueen
cml.hasvibrationalfrequenciestrueen
cml.numberofjobs2en
cml.hasmolecularorbitalsfalseen
Appears in Collections:OxidativeAddition



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