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Manuscript title: Anion- and water-facilitated oxidative carbon–carbon bond cleavage and diketonate carboxylation in Cu(II) chlorodiketonate complexes

Journal: Inorg. Chim. Acta

DOI: 10.1016/j.ica.2024.122203

Full metadata record
DC FieldValueLanguage
dc.contributor.authorBorowski, Tomasz-
dc.coverage.spatialES Girona-
dc.date.accessioned2024-01-08T11:34:34Z-
dc.date.available2024-01-08T11:34:34Z-
dc.date.created2024-01-08T12:34:33.429+01:00-
dc.date.issued2024-01-08T12:34:33.429+01:00-
dc.identifier.urihttps://iochem.udg.edu:8443/browse/handle/100/5112-
dc.descriptiontransition state-
dc.publisherICSC PAS-
dc.relationOriginal title: Anion- and water-facilitated oxidative carbon–carbon bond cleavage and diketonate carboxylation in Cu(II) chlorodiketonate complexes DOI: 10.1016/j.ica.2024.122203 Journal: Inorg. Chim. Acta*
dc.relation.ispartofhttp://dx.doi.org/10.19061/iochem-bd-4-70-
dc.relation.urihttp://dx.doi.org/10.1016/j.ica.2024.122203*
dc.rightsCC BY 4.0 (c) UdG, 2024-
dc.rights.urihttp://creativecommons.org/licenses/by/4.0/-
dc.titleTS_3_Cl_H2O_O2-
dc.typedataset-
dc.date.updated2024-01-08T11:34:34Z-
cml.program.nameGaussianen
cml.program.version16en
cml.program.otherES64L-G16RevC.01en
cml.methodUB3LYPen
cml.basissetDEF2TZVPen
cml.multiplicity2en
cml.spintypeUnrestricteden
cml.shelltypeopenen
cml.charge0en
cml.energy.value-4012.009083en
cml.energy.unitsEhen
cml.formula.genericC25H20Cl2CuN2O5en
cml.calculationtypeSingle point Structureen
cml.hassolventtrueen
cml.hasvibrationalfrequenciesfalseen
cml.numberofjobs1en
cml.hasmolecularorbitalsfalseen
Appears in Collections:Bpy_Cu_enolate - DOI: 10.19061/iochem-bd-4-70



Please use this identifier to cite or link to this item: https://iochem.udg.edu/browse/handle/100/5112

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