Please use this identifier to cite or link to this item: http://hdl.handle.net/11455/35186
DC FieldValueLanguage
dc.contributor.authorChen, Ching-Chinen_US
dc.contributor.authorPeter, P.-Y.Chenen_US
dc.date2012zh_TW
dc.date.accessioned2014-06-06T07:48:55Z-
dc.date.available2014-06-06T07:48:55Z-
dc.identifier.urihttp://hdl.handle.net/11455/35186-
dc.description.abstractCalculable results: Complex density functional calculations and spin distribution analyses have been performed for planar and saddled iron(III) porphyrin complexes (see picture). The spin populations and the extent of the interactions between the metal and the porphyrin orbitals were determined, which can explain the large change of meso-carbon atom chemical shifts observed for different porphyrin ligands.en_US
dc.language.isoen_USzh_TW
dc.relationAngewandte Chemie, Volume 51, Issue 37, page(s) 9325–9329.en_US
dc.relation.urihttp://dx.doi.org/10.1002/anie.201203308en_US
dc.subjectdensity functional calculationsen_US
dc.subjectelectronic structureen_US
dc.subjectironen_US
dc.subjectNMR spectroscopyen_US
dc.subjectporphyrinsen_US
dc.titleParamagnetic NMR Shifts for Saddle-Shaped Five-Coordinate Iron(III) Porphyrin Complexes with Intermediate-Spin Structureen_US
dc.typeJournal Articlezh_TW
dc.identifier.doi10.1002/anie.201203308zh_TW
dc.contributor.catalogerWei Chun Wangen_US
item.languageiso639-1en_US-
item.openairetypeJournal Article-
item.cerifentitytypePublications-
item.grantfulltextnone-
item.fulltextno fulltext-
item.openairecristypehttp://purl.org/coar/resource_type/c_18cf-
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