Determination of enthalpies of formation of organic free radicals from bond dissociation energies 2. Halosubstituted radicals |
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Authors: | Yu D Orlov R Kh Zaripov Yu A Lebedev |
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Institution: | (1) Tver' State University, 33 ul. Zhelyabova, 170000 Tver', Russian Federation;(2) Institute of Chemistry of Non-Aqueous Solutions, Russian Academy of Sciences, 1 ul. Akademicheskaya, 153045 Ivanovo, Russian Federation |
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Abstract: | The enthalpies of formation (ΔH
f
o) for 23 halosubstituted radicals were determined from the published data on bond dissociation energies. The ΔH
f
o values of the corresponding molecules necessary for the calculation of ΔH
f
o of the radicals were taken from handbooks or calculated by the additive-group method. The conjugation energies of the radicals
are calculated, and the effect of substituents at the π-system on these values was shown. Errors of determination of the ΔH
f
o values of the radicals were estimated.
For Part 1, see Ref. 1.
Translated fromIzvestiya Akademii Nauk. Seriya Khimicheskaya, No. 4, pp. 643–646, April, 1998. |
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Keywords: | thermochemical properties halosubstituted radicals calculations of properties |
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