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Manuscript title: On the Structure and Reaction Mechanism of Human Acireductone Dioxygenase

Journal: Chem. Eur. J.

DOI: 10.1002/chem.201704617

Full metadata record
DC FieldValueLanguage
dc.contributor.authorBorowski, Tomasz-
dc.coverage.spatialES Girona Girona-
dc.date.accessioned2017-10-30T10:54:15Z-
dc.date.available2017-10-30T10:54:15Z-
dc.date.created2017-10-30T11:54:13.619+01:00-
dc.date.issued2017-10-30T11:54:13.619+01:00-
dc.identifier.urihttps://iochem.udg.edu:8443/browse/handle/100/379-
dc.descriptionorca mossbauer with point charges-
dc.publisherUdG-
dc.relationOriginal title: On the Structure and Reaction Mechanism of Human Acireductone Dioxygenase DOI: 10.1002/chem.201704617 Journal: Chem. Eur. J.*
dc.relation.urihttp://dx.doi.org/10.1002/chem.201704617*
dc.rightsCC BY 4.0 (c) UdG, 2017-
dc.rights.urihttp://creativecommons.org/licenses/by/4.0/-
dc.titleM4_Orca-
dc.typedataset-
dc.date.updated2017-10-30T10:54:15Z-
cml.program.nameOrcaen
cml.program.version3.0.3en
cml.program.otherRELEASEen
cml.methodDFTen
cml.basissetSV(P)en
cml.multiplicity5en
cml.spintypeUnrestricteden
cml.charge1en
cml.energy.value-3474.06592902en
cml.energy.unitsEhen
cml.formula.genericC 25 H 57 Fe 1 N 10 O 9en
cml.calculationtypeGeometry optimizationen
cml.hassolventfalseen
cml.hasvibrationalfrequenciesfalseen
cml.numberofjobs1en
cml.hasmolecularorbitalsfalseen
Appears in Collections:Fe-hARD_Mossbauer - DOI: 10.19061/iochem-bd-4-4



Please use this identifier to cite or link to this item: https://iochem.udg.edu/browse/handle/100/379

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