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Manuscript title: Photochromism and Dual-Color Fluorescence in a Polyoxometalate–Benzospiropyran Molecular Switch

Journal: Angew. Chem. Int. Ed.

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DC FieldValueLanguage
dc.contributor.authorSerapian, Stefano-
dc.date.accessioned2017-01-30T23:20:26Z-
dc.date.available2017-03-16T10:08:14Z-
dc.date.created2017-01-31T00:20:25.261+01:00-
dc.date.issued2017-01-31T00:20:25.261+01:00-
dc.identifier.urihttps://iochem-bd.iciq.es/browse/handle/100/1886-
dc.description.2_Optimization_and_Frequencies-
dc.publisherInstitute of Chemical Research of Catalonia-
dc.relationOriginal title: Photochromism and Dual-Color Fluorescence in a Polyoxometalate–Benzospiropyran Molecular Switch Journal: Angew. Chem. Int. Ed.*
dc.relation.ispartofhttp://dx.doi.org/10.19061/iochem-bd-1-27-
dc.rightsCC BY 4.0 (c) Institute of Chemical Research of Catalonia, 2017-
dc.rights.urihttp://creativecommons.org/licenses/by/4.0/-
dc.title_2_Optimization_and_Frequencies-
dc.typedataset-
dc.date.updated2017-01-30T23:20:26Z-
cml.program.nameGaussianen
cml.program.version09en
cml.program.otherEM64L-G09RevD.01en
cml.methodRPBE1PBEen
cml.multiplicity1en
cml.spintypeRestricteden
cml.shelltypeCloseden
cml.charge0en
cml.energy.value-1568.60879801en
cml.energy.unitsEhen
cml.formula.genericC32H26N2O3en
cml.calculationtypeGeometry optimization Minimumen
cml.hassolventtrueen
cml.hasvibrationalfrequenciestrueen
cml.numberofjobs2en
cml.hasmolecularorbitalsfalseen
Appears in Collections:Photochromism and Dual-Color Fluorescence in a Polyoxometalate–Benzospiropyran Molecular Switch



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