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1078 related items for PubMed ID: 17585739
1. 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 [Abstract] [Full Text] [Related]
2. Thermochemical properties and bond dissociation enthalpies of 3- to 5-member ring cyclic ether hydroperoxides, alcohols, and peroxy radicals: cyclic ether radical + (3)O(2) reaction thermochemistry. Auzmendi-Murua I, Bozzelli JW. J Phys Chem A; 2014 May 01; 118(17):3147-67. PubMed ID: 24660891 [Abstract] [Full Text] [Related]
3. Chain branching and termination in the low-temperature combustion of n-alkanes: 2-pentyl radical + O2, isomerization and association of the second O2. Asatryan R, Bozzelli JW. J Phys Chem A; 2010 Jul 29; 114(29):7693-708. PubMed ID: 20604539 [Abstract] [Full Text] [Related]
4. Thermochemical properties and bond dissociation energies of C3-C5 cycloalkyl hydroperoxides and peroxy radicals: cycloalkyl radical + (3)O2 reaction thermochemistry. Auzmendi-Murua I, Bozzelli JW. J Phys Chem A; 2012 Jul 19; 116(28):7550-63. PubMed ID: 22779400 [Abstract] [Full Text] [Related]
5. Thermochemical and kinetic analysis of the thermal decomposition of monomethylhydrazine: an elementary reaction mechanism. Sun H, Law CK. J Phys Chem A; 2007 May 17; 111(19):3748-60. PubMed ID: 17388291 [Abstract] [Full Text] [Related]
6. Formation of a Criegee intermediate in the low-temperature oxidation of dimethyl sulfoxide. Asatryan R, Bozzelli JW. Phys Chem Chem Phys; 2008 Apr 07; 10(13):1769-80. PubMed ID: 18350182 [Abstract] [Full Text] [Related]
7. Thermochemical and kinetic analysis on the reactions of O2 with products from OH addition to isobutene, 2-hydroxy-1,1-dimethylethyl, and 2-hydroxy-2-methylpropyl radicals: HO2 formation from oxidation of neopentane, Part II. Sun H, Bozzelli JW, Law CK. J Phys Chem A; 2007 Jun 14; 111(23):4974-86. PubMed ID: 17511431 [Abstract] [Full Text] [Related]
8. Structure and thermochemical properties of 2-methoxyfuran, 3-methoxyfuran, and their carbon-centered radicals using computational chemistry. Hudzik JM, Bozzelli JW. J Phys Chem A; 2010 Aug 05; 114(30):7984-95. PubMed ID: 20666545 [Abstract] [Full Text] [Related]
9. Thermochemical properties of methyl-substituted cyclic alkyl ethers and radicals for oxiranes, oxetanes, and oxolanes: C-H bond dissociation enthalpy trends with ring size and ether site. Auzmendi-Murua I, Charaya S, Bozzelli JW. J Phys Chem A; 2013 Jan 17; 117(2):378-92. PubMed ID: 23194387 [Abstract] [Full Text] [Related]
10. Structures, internal rotor potentials, and thermochemical properties for a series of nitrocarbonyls, nitroolefins, corresponding nitrites, and their carbon centered radicals. Snitsiriwat S, Asatryan R, Bozzelli JW. J Phys Chem A; 2011 Dec 01; 115(47):13921-30. PubMed ID: 22010966 [Abstract] [Full Text] [Related]
11. Cyclopentadienone Oxidation Reaction Kinetics and Thermochemistry for the Alcohols, Hydroperoxides, and Vinylic, Alkoxy, and Alkylperoxy Radicals. Yommee S, Bozzelli JW. J Phys Chem A; 2016 Jan 28; 120(3):433-51. PubMed ID: 26784854 [Abstract] [Full Text] [Related]
12. Thermodynamic properties (enthalpy, bond energy, entropy, and heat capacity) and internal rotor potentials of vinyl alcohol, methyl vinyl ether, and their corresponding radicals. da Silva G, Kim CH, Bozzelli JW. J Phys Chem A; 2006 Jun 29; 110(25):7925-34. PubMed ID: 16789782 [Abstract] [Full Text] [Related]
13. 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 [Abstract] [Full Text] [Related]