An assessment of theoretical procedures for the calculation of reliable radical stabilization energies
The performance of a variety of theoretical methods in computing stabilization energies of the substituted methyl and vinyl radicals•CH2F,•CH2CN,•CH2CH=CH2,•CH2CH=O, CH2=C•F and CH2=C•CN is examined. The influence of electron correlation (UHF,
|Collections||ANU Research Publications|
|Source:||Journal of the Chemical Society, Perkin Transactions 2|
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