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dc.contributor.authorCook, Julian B.en_US
dc.contributor.authorNicholson, Brian K.en_US
dc.contributor.authorSmith, Derek W.en_US
dc.date.accessioned2008-03-19T05:08:05Z
dc.date.available2007-08-30en_US
dc.date.available2008-03-19T05:08:05Z
dc.date.issued2004-02-01en_US
dc.identifier.citationCook, J.B., Nicholson, B.K. and Smith D.W. (2004). A structural, spectroscopic and theoretical study of the triphenylphosphine chalcogenide complexes of tungsten carbonyl, [W(XPPh3)(CO)5], X = O, S, Se. Journal of Organometallic Chemistry, 689, 860-869.en_US
dc.identifier.urihttps://hdl.handle.net/10289/171
dc.description.abstractThe series [W(XPPh3)(CO)5], X=O, S, Se has been structurally determined by X-ray crystallography and fully characterised spectroscopically to provide data for comparing the bonding of the Ph3PX ligands to the metal. The P-X-W angles are 134.3°, 113.2° and 109.2°, respectively, for X=O, S, Se. The bonding has been analysed using EHMO calculations which suggest that lower P-X-W angles depend on the relative importance of σ-bonding, which in turn depends on the chalcogen in the order X=Se > S > O. The effect is enhanced by lower energies of the metal σ and π orbital energies.en_US
dc.format.mimetypeapplication/pdf
dc.language.isoen
dc.publisherElsevier B.V.en_NZ
dc.relation.urihttp://www.elsevier.com/wps/find/journaldescription.cws_home/504090/description#descriptionen_US
dc.rightsThis is an authors version of an article published in the, Journal of Organometallic Chemistry, (c) 2004 Elsevier Science B.V.en_US
dc.subjecttungsten carbonylen_US
dc.subjecttriphenylphosphine oxideen_US
dc.subjecttriphenylphosphine sulphideen_US
dc.subjecttriphenylphosphine selenideen_US
dc.subjectx-ray structureen_US
dc.subjectEHMO calculationsen_US
dc.titleA structural, spectroscopic and theoretical study of the triphenylphosphine chalcogenide complexes of tungsten carbonyl, [W(XPPh3)(CO)5], X=O, S, Seen_US
dc.typeJournal Articleen_US
dc.identifier.doi10.1016/j.jorganchem.2003.12.016en_US
dc.relation.isPartOfJournal of Organometallic Chemistryen_NZ
pubs.begin-page860en_NZ
pubs.editionFebruaryen_NZ
pubs.elements-id29816
pubs.end-page869en_NZ
pubs.issue4en_NZ
pubs.volume689en_NZ


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