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dc.contributor.authormontilla, marc-
dc.coverage.spatialES Girona-
dc.date.accessioned2021-07-23T15:12:04Z-
dc.date.available2021-07-23T15:12:04Z-
dc.date.created2021-07-23T17:12:02.66+02:00-
dc.date.issued2021-07-23T17:12:02.66+02:00-
dc.identifier.urihttps://iochem.udg.edu:8443/browse/handle/100/1648-
dc.descriptionTS1: N2 release.-
dc.publisherUdG-
dc.relation.ispartofhttp://dx.doi.org/10.19061/iochem-bd-4-29-
dc.rightsCC BY 4.0 (c) UdG, 2021-
dc.rights.urihttp://creativecommons.org/licenses/by/4.0/-
dc.titleTS1-
dc.typedataset-
dc.date.updated2021-07-23T15:12:04Z-
cml.program.nameGaussianen
cml.program.version16en
cml.program.otherES64L-G16RevA.03en
cml.methodRrevTPSSrevTPSSen
cml.basissetDEF2TZVPen
cml.multiplicity1en
cml.spintypeen
cml.shelltypeCloseden
cml.charge1en
cml.energy.value-2791.9900957en
cml.energy.unitsEhen
cml.formula.genericC24H26HeN6O2en
cml.calculationtypeSingle point Structureen
cml.hassolventtrueen
cml.hasvibrationalfrequenciesfalseen
cml.numberofjobs1en
cml.hasmolecularorbitalsfalseen
Appears in Collections:Masked_nitrene - DOI: 10.19061/iochem-bd-4-29



Please use this identifier to cite or link to this item: https://iochem.udg.edu:8443/browse/handle/100/1648

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