Enthalpies of formation of phenylaminyl radicals

被引：0
|
作者：
Chernova E.M. [1 ]
Orlov M.Y. [1 ]
Turovtsev V.V. [1 ]
Orlov Y.D. [1 ]
机构：
[1] Tver State University, 33 ul. Zhelyabova, Tver
来源：
Russian Chemical Bulletin | 2021年 / 70卷 / 2期
关键词：
additive-group model; enthalpy of formation; free radicals; quantitative “structure—property” correlation; substituted diphenylaminyl radicals; substituted phenylaminyl radicals;
D O I：
10.1007/s11172-021-3089-3
中图分类号：
学科分类号：
摘要：
Enthalpies of formation (ΔfH∘) for 31 radicals of the series of substituted Ph-N∙H and Ph-N∙-Ph were determined for the first time. The calculations were based on the dissociation energies of N-H bonds in the corresponding molecules and their ΔfH∘. A quantitative “structure—enthalpy of formation” correlation was established for these radicals within the framework of the additive-group approach. The ΔfH∘ of radicals were analyzed and the most reliable values were suggested. © 2021, Springer Science+Business Media LLC.
引用
收藏
页码：330 / 335
页数：5
相关论文
共 50 条
12345