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A novel interpretation of bonding in [1.1.1] propellane and theoretical calculation of its unimolecular rearrangement

โœ Scribed by Adriana B. Pierini; Hector F. Reale; Jorge A. Medrano

Book ID
119116660
Publisher
Elsevier Science
Year
1986
Tongue
English
Weight
643 KB
Volume
148
Category
Article
ISSN
0166-1280

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Theoretical study of the 1J(13C13C) indi
Theoretical study of the 1J(13C13C) indirect nuclear spin-spin coupling constant of the bridgehead bond in [1.1.1]propellane and related systems
โœ V. Galasso ๐Ÿ“‚ Article ๐Ÿ“… 1994 ๐Ÿ› Elsevier Science ๐ŸŒ English โš– 350 KB

Ab initio calculations using the equations of motion approach are reported for 'J( 13C"C) of the bridgehead bond in [ 1.1.1 I-, 12.1.1 I-, [2.2.1 I-, [2.2.2]-, [3.2.1 ]-propellane, bicyclobutane, bicyclopentane, bicyclohexane and tetracyclopentane. The results give an overall picture of the influenc