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

页码：330 / 335

页数：5

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