IUPAC CRITICAL EVALUATION OF THERMOCHEMICAL …

IUPAC CRITICAL EVALUATION OF THERMOCHEMICAL …

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时间:2019-06-18

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1、IUPACCRITICALEVALUATIONOFTHERMOCHEMICALPROPERTIESOFSELECTEDRADICALS.PARTI1BrankoRuscicChemistryDivision,ArgonneNationalLaboratory,Argonne,Illinois60439,U.S.A.JamesE.BoggsDepartmentofChemistry,UniversityofTexas,Austin,Texas78712-1167,U.S.A.AlexanderBurcatFacultyofA

2、erospaceEngineering,Technion-IsraelInstituteofTechnology,Haifa32000,IsraelAttilaG.CsászárDepartmentofTheoreticalChemistry,LorándEötvösUniversity,1117Budapest,HungaryJeanDemaisonLaboratoiredePhysiquedesLasers,AtomesetMolecules,UniversitedeLilleI,59655Villeneuved'As

3、cq,FranceRudolfJanoschekKarl-Franzens-Universität,InstitutfürTheoretischeChemie,8010Graz,AustriaJanM.L.MartinDepartmentofOrganicChemistry,WeizmannInstituteofScience,76100Rechovot,IsraelMelitaL.MortonChemistryDivision,ArgonneNationalLaboratory,Argonne,Illinois60439

4、,U.S.A.MichelJ.RossiLPA-LaboratoiredePollutionAtmosphérique,ENAC-FacultéEnvironmentNaturelConstruit,EPFL-EcolePolytechniqueFédéraledeLausanne,1015Lausanne,SwitzerlandJohnF.StantonDepartmentofChemistry,UniversityofTexas,Austin,Texas78712-1167,U.S.A.PéterG.SzalayDep

5、artmentofTheoreticalChemistry,LorándEötvösUniversity,1117Budapest,HungaryPhillipR.WestmorelandDepartmentofChemicalEngineering,UniversityofMassachusettsAmherst,Amherst,Massachusetts01003-9330,U.S.A.FriedhelmZabelInstitutfürPhysikalischeChemie,StuttgartUniversität,7

6、0569Stuttgart,GermanyTiborBérces(Chairman)InstituteofChemistry,ChemicalResearchCenter,HungarianAcademyofSciences,1025Budapest,HungaryAbstractThisisthefirstpartofaseriesofarticlesreportingcriticallyevaluatedthermochemicalpropertiesofselectedfreeradicals.Thepresenta

7、rticleconsistsofthecontainsdatasheetsforof11radicals:includingCH,CH2(triplet),CH2(singlet),CH3,CH2OH,CH3O,CH3CO,C2H5O,C6H5CH2,OH,andNH2.Thethermochemicalpropertiesdiscussedaretheenthalpyofformation,aswellastheheatcapacity,integratedheatcapacityandentropyoftheradic

8、als.Onedistinguishingfeatureofthepresentevaluationisthesystematicutilizationofavailablekinetic,spectroscopicandionthermochemicaldataaswellashigh-levelth

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