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dc.contributor.authorKnott, Jackson P.
dc.contributor.authorHänninen, Mikko M.
dc.contributor.authorRautiainen, J. Mikko
dc.contributor.authorTuononen, Heikki M.
dc.contributor.authorHayes, Paul G.
dc.date.accessioned2017-08-10T06:16:12Z
dc.date.available2019-04-14T21:35:17Z
dc.date.issued2017
dc.identifier.citationKnott, J. P., Hänninen, M. M., Rautiainen, J. M., Tuononen, H. M., & Hayes, P. G. (2017). Insights into the decomposition pathway of a lutetium alkylamido complex via intramolecular C–H bond activation. <i>Journal of Organometallic Chemistry</i>, <i>845</i>, 135-143. <a href="https://doi.org/10.1016/j.jorganchem.2017.04.008" target="_blank">https://doi.org/10.1016/j.jorganchem.2017.04.008</a>
dc.identifier.otherCONVID_26987021
dc.identifier.otherTUTKAID_73690
dc.identifier.urihttps://jyx.jyu.fi/handle/123456789/55059
dc.description.abstractSynthesis, characterization and reaction chemistry of lutetium alkylamido LLu(CH2SiMe3)(NHCPh3) (2), L = 2,5-[Ph2P=N(4-iPrC6H4)]2N(C4H2)–, is reported. Complex 2 undergoes cyclometalation of the NHCPh3 ligand at elevated temperatures to produce the orthometalated complex LLu(κ2−N,C-(NHCPh2(C6H4))) (3) which converts to 0.5 equivalents of bis(amido) LLu(NHCPh3)2 (4) upon heating at 80 °C for 24 h. Reaction of complex 2 with 4-dimethylaminopyridine (DMAP) does not promote alkane elimination nor imido formation. A kinetic analysis of the thermal decomposition of complex 2, supported by deuterium labelling studies and computational analysis (PBE0/def2-TZVP/SDD(Lu)), indicate direct Csp2–H activation, rather than C–H addition across a transient LLu=NCPh3 species, occurs.en
dc.languageeng
dc.language.isoeng
dc.publisherElsevier B.V.
dc.relation.ispartofseriesJournal of Organometallic Chemistry
dc.subject.otherlutetium
dc.titleInsights into the decomposition pathway of a lutetium alkylamido complex via intramolecular C–H bond activation
dc.typearticle
dc.identifier.urnURN:NBN:fi:jyu-201707213344
dc.contributor.laitosKemian laitosfi
dc.contributor.laitosDepartment of Chemistryen
dc.contributor.oppiaineEpäorgaaninen ja analyyttinen kemiafi
dc.contributor.oppiaineFysikaalinen kemiafi
dc.contributor.oppiaineNanoscience Centerfi
dc.contributor.oppiaineInorganic and Analytical Chemistryen
dc.contributor.oppiainePhysical Chemistryen
dc.contributor.oppiaineNanoscience Centeren
dc.type.urihttp://purl.org/eprint/type/JournalArticle
dc.date.updated2017-07-21T06:30:31Z
dc.type.coarhttp://purl.org/coar/resource_type/c_2df8fbb1
dc.description.reviewstatuspeerReviewed
dc.format.pagerange135-143
dc.relation.issn0022-328X
dc.relation.numberinseries0
dc.relation.volume845
dc.type.versionacceptedVersion
dc.rights.copyright© 2017 Elsevier B.V. This is a final draft version of an article whose final and definitive form has been published by Elsevier. Published in this repository with the kind permission of the publisher.
dc.rights.accesslevelopenAccessfi
dc.relation.grantnumber282499
dc.relation.grantnumber274505
dc.subject.ysokompleksiyhdisteet
jyx.subject.urihttp://www.yso.fi/onto/yso/p30190
dc.relation.doi10.1016/j.jorganchem.2017.04.008
dc.relation.funderResearch Council of Finlanden
dc.relation.funderResearch Council of Finlanden
dc.relation.funderSuomen Akatemiafi
dc.relation.funderSuomen Akatemiafi
jyx.fundingprogramAcademy Project, AoFen
jyx.fundingprogramPostdoctoral Researcher, AoFen
jyx.fundingprogramAkatemiahanke, SAfi
jyx.fundingprogramTutkijatohtori, SAfi
jyx.fundinginformationThis research was generously supported by the Natural Sciences and Engineering Research Council (NSERC) of Canada (341687), the Canada Foundation for Innovation (CFI), the Academy of Finland (282499 and 274505) and the University of Jyväskylä. We are grateful to the Finnish CSC-IT Center for Science for allocation of computational resources. Mr. Tony Montina is acknowledged for expert technical assistance.
dc.type.okmA1


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