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Ab initio mechanistic study of radical reactions. Relative reactivity of olefinic and acetylenic bonds in addition reactions

โœ Scribed by Nagase, Shigeru; Kern, C. William

Book ID
126130441
Publisher
American Chemical Society
Year
1980
Tongue
English
Weight
402 KB
Volume
102
Category
Article
ISSN
0002-7863

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Ab initio mechanistic studies of radical
Ab initio mechanistic studies of radical reactions. Addition of methyl radical to acetylene and ethylene
โœ Roger Arnaud; Vincenzo Barone; Santiago Olivella; Albert Sole ๐Ÿ“‚ Article ๐Ÿ“… 1985 ๐Ÿ› Elsevier Science ๐ŸŒ English โš– 576 KB

Addition of metbyl radicals to ethylene and acetylene has been studwd by nb mitio molecular-orbital calculauons In agreemen! with expcrimenlal dam, we find that, although addition IO ethylene is charactenred by a lower activation energy. addition LO acetylene is faster due to the opposile and larger