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An ab initio calculation of the cyclopropylcarbinyl radical

โœ Scribed by H.Bernhard Schlegel; Frederick W. King

Publisher
Elsevier Science
Year
1976
Tongue
English
Weight
331 KB
Volume
35
Category
Article
ISSN
0022-2860

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๐Ÿ“œ SIMILAR VOLUMES

Ab initio calculations on the benzyl rad
Ab initio calculations on the benzyl radical
โœ A. Hinchliffe ๐Ÿ“‚ Article ๐Ÿ“… 1972 ๐Ÿ› Elsevier Science ๐ŸŒ English โš– 96 KB

An ab initio calculation of the ESR.proton coupling constants in the benzyl radical is reported. The results compare reasonably well with experLrnent aa~d are similar to those obtained from semi-empirical rr electron calculations.

ChemInform Abstract: Ab initio Molecular
ChemInform Abstract: Ab initio Molecular Orbital Calculations of Electronic Effects on the Kinetics of Cyclopropylcarbinyl Radical Ring Openings.
โœ F. N. MARTINEZ; H. B. SCHLEGEL; M. NEWCOMB ๐Ÿ“‚ Article ๐Ÿ“… 2010 ๐Ÿ› John Wiley and Sons โš– 26 KB ๐Ÿ‘ 2 views

Ab initio Molecular Orbital Calculations of Electronic Effects on the Kinetics of Cyclopropylcarbinyl Radical Ring Openings. -The heats of reaction and barriers for ring opening of cyclopropylcarbinyl radicals with a vinyl or methoxy substituent at each possible position or a methyl substituent at