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Manuscript title: Exploring the role of coinage metallates in trifluoromethylation: a combined experimental and theoretical study

Journal: Chem. Eur. J.

DOI: 10.1002/chem.201900496

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DC FieldValueLanguage
dc.contributor.authorMudarra, Ángel Luís-
dc.date.accessioned2019-02-05T09:17:23Z-
dc.date.available2019-02-05T09:17:23Z-
dc.date.created2019-02-05T10:17:22.386+01:00-
dc.date.issued2019-02-05T10:17:22.386+01:00-
dc.identifier.urihttps://iochem-bd.iciq.es/browse/handle/100/18067-
dc.descriptionI-nega-
dc.publisherInstitute of Chemical Research of Catalonia-
dc.relationOriginal title: Exploring the role of coinage metallates in trifluoromethylation: a combined experimental and theoretical study DOI: 10.1002/chem.201900496 Journal: Chem. Eur. J.-
dc.relation.ispartofhttp://dx.doi.org/10.19061/iochem-bd-1-111-
dc.relation.urihttp://dx.doi.org/10.1002/chem.201900496-
dc.rightsCC BY 4.0 (c) Institute of Chemical Research of Catalonia, 2019-
dc.rights.urihttp://creativecommons.org/licenses/by/4.0/-
dc.titleI-nega-
dc.typedataset-
dc.date.updated2019-02-05T09:17:23Z-
cml.program.nameGaussianen
cml.program.version09en
cml.program.otherEM64L-G09RevD.01en
cml.methodRM06en
cml.basissetSDDen
cml.multiplicity1en
cml.spintypeRestricteden
cml.shelltypeCloseden
cml.charge-1en
cml.energy.value-11.5726270541en
cml.energy.unitsEhen
cml.formula.genericIen
cml.calculationtypeGeometry optimization TSen
cml.hassolventtrueen
cml.hasvibrationalfrequenciesfalseen
cml.numberofjobs2en
cml.hasmolecularorbitalsfalseen
Appears in Collections:Triad-ate-type-complexes



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