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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.
J Phys Chem A. 2013 Jan 17;117(2):378-92. doi: 10.1021/jp309775h. Epub 2013 Jan 2.
J Phys Chem A. 2013.
PMID: 23194387
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.
Auzmendi-Murua I, et al.
J Phys Chem A. 2012 Jul 19;116(28):7550-63. doi: 10.1021/jp302699s. Epub 2012 Jul 10.
J Phys Chem A. 2012.
PMID: 22779400
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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.
Auzmendi-Murua I, et al.
J Phys Chem A. 2014 May 1;118(17):3147-67. doi: 10.1021/jp412590g. Epub 2014 Apr 17.
J Phys Chem A. 2014.
PMID: 24660891
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Mercury oxidation via chlorine, bromine, and iodine under atmospheric conditions: thermochemistry and kinetics.
Auzmendi-Murua I, Castillo Á, Bozzelli JW.
Auzmendi-Murua I, et al.
J Phys Chem A. 2014 Apr 24;118(16):2959-75. doi: 10.1021/jp412654s. Epub 2014 Apr 15.
J Phys Chem A. 2014.
PMID: 24661061
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