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Manuscript title: Redefining the Mechanistic Scenario of Carbon–Sulfur Nucleophilic Coupling via High-Valent Cp*Co(IV) Species

Journal: Angew. Chem. Int. Ed.

DOI: 10.1002/anie.202101390

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DC FieldValueLanguage
dc.contributor.authorLopez Resano, Sara-
dc.date.accessioned2021-01-28T08:08:20Z-
dc.date.available2021-03-19T11:59:24Z-
dc.date.created2021-01-28T09:08:18.174+01:00-
dc.date.issued2021-01-28T09:08:18.174+01:00-
dc.identifier.urihttps://iochem-bd.iciq.es/browse/handle/100/27792-
dc.descriptionComplex 2 Co(III) singlet-
dc.publisherInstitute of Chemical Research of Catalonia-
dc.relationOriginal title: Redefining the Mechanistic Scenario of Carbon–Sulfur Nucleophilic Coupling via High-Valent Cp*Co(IV) Species DOI: 10.1002/anie.202101390 Journal: Angew. Chem. Int. Ed.*
dc.relation.ispartofhttp://dx.doi.org/10.19061/iochem-bd-1-193-
dc.relation.urihttp://dx.doi.org/10.1002/anie.202101390*
dc.rightsCC BY 4.0 (c) Institute of Chemical Research of Catalonia, 2021-
dc.rights.urihttp://creativecommons.org/licenses/by/4.0/-
dc.subjectReductive elimination-
dc.subjectHigh-valent-
dc.subjectCobalt-
dc.title/Single_points Co-ppy-SCF3-
dc.typedataset-
dc.date.updated2021-01-28T08:08:20Z-
cml.program.nameGaussianen
cml.program.version09en
cml.program.otherEM64L-G09RevD.01en
cml.methodRM06en
cml.basisset6-311++G** GENECPen
cml.spintypeRestricteden
cml.shelltypeCloseden
cml.energy.value-1749.4124427en
cml.energy.unitsEhen
cml.formula.genericC22H23CoF3NSen
cml.calculationtypeSingle point Structureen
cml.hassolventtrueen
cml.hasvibrationalfrequenciesfalseen
cml.numberofjobs1en
cml.hasmolecularorbitalsfalseen
Appears in Collections:Redefining the Mechanistic Scenario of Carbon–Sulfur Nucleophilic Coupling via High-Valent Cp*Co(IV) Species - DOI: 10.19061/iochem-bd-1-193



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