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Prediction of the reactive intermediates in alkane activation by tris(pyrazolyl borate)rhodium carbonyl

dc.creatorZarić, Snežana D.
dc.creatorHall, Michael B.
dc.date.accessioned2018-11-22T00:02:00Z
dc.date.available2018-11-22T00:02:00Z
dc.date.issued1998
dc.identifier.issn1089-5639
dc.identifier.urihttps://cherry.chem.bg.ac.rs/handle/123456789/368
dc.description.abstractTwo intermediates are observed in the time-resolved IR spectra of the photoinitiated alkane (RH) activation reaction of Tp*Rh(CO)(2) (Tp* = HB-(3,5-dimethylpyrazolyl). Density functional calculations suggest that the first observed intermediate is (eta(3)-Tp*)Rh(CO)...(RH) (RH weakly bound), which subsequently rearranges to (eta(2)-Tp*)Rh(CO)(RH) (RH strongly bound) before undergoing oxidative addition to the product (eta(3)-Tp*)-Rh(CO)(R)(H).en
dc.publisherAmer Chemical Soc, Washington
dc.rightsrestrictedAccess
dc.sourceJournal of Physical Chemistry. Part A: Molecules, Spectroscopy, Kinetics, Environment and General Th
dc.titlePrediction of the reactive intermediates in alkane activation by tris(pyrazolyl borate)rhodium carbonylen
dc.typearticle
dc.rights.licenseARR
dcterms.abstractХалл, МБ; Зарић, Снежана;
dc.citation.volume102
dc.citation.issue11
dc.citation.spage1963
dc.citation.epage1964
dc.identifier.wos000072622400011
dc.identifier.doi10.1021/jp971713f
dc.citation.other102(11): 1963-1964
dc.citation.rankM21
dc.type.versionpublishedVersionen
dc.identifier.scopus2-s2.0-0001269224


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