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Bonding and Electron Delocalization in Ruthenium(III) σ-Arylacetylide Radicals [ trans -Cl(η 2 -dppe) 2 RuC≡C(4-C 6 H 4 X)] + (X = NO 2 , C(O)H, C(O)Me, F, H, OMe, NMe 2 ): Misleading Aspects of the ESR Anisotropy.

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dc.contributor.authorGauthier, Nicolas
dc.contributor.authorTchouar, Noureddine
dc.contributor.authorJustaud, Frederic
dc.contributor.authorArgouarch, Gilles
dc.contributor.authorCifuentes, Marie
dc.contributor.authorToupet, Loic
dc.contributor.authorTouchard, Daniel
dc.contributor.authorHalet, Jean-Francois
dc.contributor.authorRigaut, Stephane
dc.contributor.authorCostuas, Karine
dc.contributor.authorPaul, Frederic
dc.contributor.authorHumphrey, Mark
dc.date.accessioned2015-12-10T22:35:11Z
dc.date.issued2009
dc.date.updated2016-02-24T10:42:41Z
dc.description.abstractThe bonding within the series of [trans-Cl(η2-dppe) 2RuC≡C(4-C6H4X)]n+ complexes (1-Xn+; n = 1, 0 and X = NO2, C(O)H, C(O)Me, F, H, OMe, NMe2) has been examined by IR, ESR, and UV-vis-near-IR spectroscopy together with computational modeling. A strong
dc.identifier.issn0276-7333
dc.identifier.urihttp://hdl.handle.net/1885/56158
dc.publisherAmerican Chemical Society
dc.sourceOrganometallics
dc.subjectKeywords: Computational modeling; Coordination spheres; Delocalization; DFT calculations; Electron-delocalization; Experimental observations; Large anisotropies; Metal fragments; Near-ir spectroscopies; Rhombic symmetries; Spin delocalization; Substituent effects;
dc.titleBonding and Electron Delocalization in Ruthenium(III) σ-Arylacetylide Radicals [ trans -Cl(η 2 -dppe) 2 RuC≡C(4-C 6 H 4 X)] + (X = NO 2 , C(O)H, C(O)Me, F, H, OMe, NMe 2 ): Misleading Aspects of the ESR Anisotropy.
dc.typeJournal article
local.bibliographicCitation.issue7
local.bibliographicCitation.lastpage2266
local.bibliographicCitation.startpage2253
local.contributor.affiliationGauthier, Nicolas, Universite de Rennes
local.contributor.affiliationTchouar, Noureddine, Universite de Rennes 1
local.contributor.affiliationJustaud, Frederic, Universite de Rennes 1
local.contributor.affiliationArgouarch, Gilles , CNRS UMR
local.contributor.affiliationCifuentes, Marie, College of Physical and Mathematical Sciences, ANU
local.contributor.affiliationToupet, Loic, Universite de Rennes 1
local.contributor.affiliationTouchard, Daniel, Universite de Rennes 1
local.contributor.affiliationHalet, Jean-Francois, Universite de Rennes 1
local.contributor.affiliationRigaut, Stephane, UniVersite de Rennes 1
local.contributor.affiliationHumphrey, Mark, College of Physical and Mathematical Sciences, ANU
local.contributor.affiliationCostuas, Karine, Universite de Rennes 1
local.contributor.affiliationPaul, Frederic, Universite de Rennes
local.contributor.authoruidCifuentes, Marie, u9410034
local.contributor.authoruidHumphrey, Mark, u9400918
local.description.embargo2037-12-31
local.description.notesImported from ARIES
local.identifier.absfor039904 - Organometallic Chemistry
local.identifier.ariespublicationu4217927xPUB353
local.identifier.citationvolume28
local.identifier.doi10.1021/om801138q
local.identifier.scopusID2-s2.0-65349159183
local.identifier.thomsonID000264932700038
local.type.statusPublished Version

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