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Journal Abstract Search

453 related items for PubMed ID: 19281146

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  • 4. Thermochemical properties, DeltafH degrees (298), S degrees (298), and Cp degrees (T), for n-butyl and n-pentyl hydroperoxides and the alkyl and peroxy radicals, transition states, and kinetics for intramolecular hydrogen shift reactions of the peroxy radicals.
    Zhu L, Bozzelli JW, Kardos LM.
    J Phys Chem A; 2007 Jul 19; 111(28):6361-77. PubMed ID: 17585739
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  • 5. Intramolecular hydrogen bonding and hydrogen atom abstraction in gas-phase aliphatic amine radical cations.
    Hammerum S, Nielsen CB.
    J Phys Chem A; 2005 Dec 29; 109(51):12046-53. PubMed ID: 16366660
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  • 6. Toluene combustion: reaction paths, thermochemical properties, and kinetic analysis for the methylphenyl radical + O2 reaction.
    da Silva G, Chen CC, Bozzelli JW.
    J Phys Chem A; 2007 Sep 06; 111(35):8663-76. PubMed ID: 17696501
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  • 7. Ab initio study of key branching reactions in biodiesel and Fischer-Tropsch fuels.
    Davis AC, Francisco JS.
    J Am Chem Soc; 2011 Nov 30; 133(47):19110-24. PubMed ID: 21805995
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  • 13. Can the C(5)H(5) + C(5)H(5) --> C(10)H(10) --> C(10)H(9) + H/C(10)H(8) + H(2) reaction produce naphthalene? An Ab initio/RRKM study.
    Mebel AM, Kislov VV.
    J Phys Chem A; 2009 Sep 10; 113(36):9825-33. PubMed ID: 19681629
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  • 14. Intramolecular homolytic translocation chemistry: an ab initio study of 1,n-silyl, germyl, and stannyl group transfer and related ring-closure reactions.
    Matsubara H, Schiesser CH.
    J Org Chem; 2003 Nov 28; 68(24):9299-309. PubMed ID: 14629150
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  • 15. The impact of resonance stabilization on the intramolecular hydrogen-atom shift reactions of hydrocarbon radicals.
    Wang K, Villano SM, Dean AM.
    Chemphyschem; 2015 Aug 24; 16(12):2635-45. PubMed ID: 26212671
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  • 16. Ab Initio/Transition-State Theory Study of the Reactions of Ċ5H9 Species of Relevance to 1,3-Pentadiene, Part I: Potential Energy Surfaces, Thermochemistry, and High-Pressure Limiting Rate Constants.
    Sun Y, Zhou CW, Somers KP, Curran HJ.
    J Phys Chem A; 2019 Oct 24; 123(42):9019-9052. PubMed ID: 31566374
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  • 17. Thermochemistry, bond energies, and internal rotor potentials of dimethyl tetraoxide.
    da Silva G, Bozzelli JW.
    J Phys Chem A; 2007 Nov 29; 111(47):12026-36. PubMed ID: 17983209
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  • 18. Ab initio study of hydrogen migration across n-alkyl radicals.
    Davis AC, Francisco JS.
    J Phys Chem A; 2011 Apr 14; 115(14):2966-77. PubMed ID: 21413772
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  • 19. Computational studies of intramolecular hydrogen atom transfers in the beta-hydroxyethylperoxy and beta-hydroxyethoxy radicals.
    Kuwata KT, Dibble TS, Sliz E, Petersen EB.
    J Phys Chem A; 2007 Jun 14; 111(23):5032-42. PubMed ID: 17508728
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  • 20. Theoretical study on the isomerization behavior between alpha,beta-unsaturated acyl radicals and alpha-ketenyl radicals.
    Matsubara H, Ryu I, Schiesser CH.
    J Org Chem; 2005 Apr 29; 70(9):3610-7. PubMed ID: 15844998
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