دورية أكاديمية

Formation enthalpies of organic oxygen-containing heterocyclic radicals.

التفاصيل البيبلوغرافية
العنوان: Formation enthalpies of organic oxygen-containing heterocyclic radicals.
المؤلفون: Orlov, Yu. D.1 Yurij.Orlov@tversu.ru, Chernova, E. M.1, Turovtsev, V. V.1
المصدر: Chemistry of Heterocyclic Compounds. Apr2011, Vol. 47 Issue 1, p29-35. 7p. 3 Charts.
مصطلحات موضوعية: *RADICALS (Chemistry), *ENTHALPY, *CHEMICAL bonds, *FUNCTIONAL groups, *ORGANIC chemistry, *OXYGEN
مستخلص: Enthalpies of formation (Δ H) of 57 oxygen-containing heterocyclic radicals have been determined from literature values of the dissociation energies of C-H chemical bonds in appropriate molecules. Within the framework of a quantitative structure-property correlation based on the additive-group model, an analysis has been carried out of the obtained Δ H values, the reliability of these data has been shown, and a set of values has been determined of the cyclic stress of the radicals being considered. The parameters of the additive-group method are recommended for the calculation of Δ H for radicals of the considered class. [ABSTRACT FROM AUTHOR]
قاعدة البيانات: Academic Search Index
الوصف
تدمد:00093122
DOI:10.1007/s10593-011-0716-1