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Rotational barriers of some CH2X radicalar compounds

✍ Scribed by D. Peeters; G. Leroy; M. Matagne


Book ID
119117199
Publisher
Elsevier Science
Year
1988
Tongue
English
Weight
479 KB
Volume
166
Category
Article
ISSN
0166-1280

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Ab Initio Calculations of the Rotational
✍ Joseph J. BelBruno πŸ“‚ Article πŸ“… 1997 πŸ› John Wiley and Sons 🌐 English βš– 139 KB πŸ‘ 2 views

The heights of the rotational barriers of the ditelluride bridge in H 2 Te 2 and (CH 3 ) 2 Te 2 have been calculated at the Hartree-Fock level with the 3-21G basis set. The minima in the rotational potential energy functions occur at torsional angles of 87.58Њ and 89.32Њ, respectively. The barriers