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Rate coefficients for intramolecular homolytic substitution of oxyacyl radicals at selenium

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dc.contributor.authorAitken, Heather
dc.contributor.authorHorvat, Sonia
dc.contributor.authorSchiesser, Carl
dc.contributor.authorLin, Ching-Yeh
dc.contributor.authorCoote, Michelle
dc.date.accessioned2015-12-10T23:05:50Z
dc.date.issued2012
dc.date.updated2016-02-24T10:44:54Z
dc.description.abstractAb initio and density functional calculations predict that intramolecular homolytic substitution reactions of oxyacyl radicals at the selenium atom in ω-alkylseleno-substituted radicals proceed via mechanisms that do not involve hypervalent intermediates
dc.identifier.issn0538-8066
dc.identifier.urihttp://hdl.handle.net/1885/62530
dc.publisherJohn Wiley & Sons Inc
dc.sourceInternational Journal of Chemical Kinetics
dc.subjectKeywords: Ab initio and density functional calculations; Gasphase; Homolytic substitution; Rate coefficients; Calculations; Density functional theory; Substitution reactions; Selenium
dc.titleRate coefficients for intramolecular homolytic substitution of oxyacyl radicals at selenium
dc.typeJournal article
local.bibliographicCitation.issue1
local.bibliographicCitation.lastpage58
local.bibliographicCitation.startpage51
local.contributor.affiliationAitken, Heather, University of Melbourne
local.contributor.affiliationHorvat, Sonia, University of Melbourne
local.contributor.affiliationSchiesser, Carl, University of Melbourne
local.contributor.affiliationLin, Ching-Yeh, College of Physical and Mathematical Sciences, ANU
local.contributor.affiliationCoote, Michelle, College of Physical and Mathematical Sciences, ANU
local.contributor.authoruidLin, Ching-Yeh, u4169280
local.contributor.authoruidCoote, Michelle, u4031074
local.description.embargo2037-12-31
local.description.notesImported from ARIES
local.identifier.absfor030501 - Free Radical Chemistry
local.identifier.absfor030701 - Quantum Chemistry
local.identifier.absseo970103 - Expanding Knowledge in the Chemical Sciences
local.identifier.ariespublicationU4217927xPUB708
local.identifier.citationvolume44
local.identifier.doi10.1002/kin.20604
local.identifier.scopusID2-s2.0-82455212785
local.identifier.thomsonID000298018700006
local.type.statusPublished Version

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