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The calculation of the electric dipole moments of some conjugated heterocyclic compounds

โœ Scribed by Orgel, L. E.; Cottrell, T. L.; Dick, W.; Sutton, L. E.

Book ID
126984495
Publisher
Royal Society of Chemistry
Year
1951
Weight
526 KB
Volume
47
Category
Article
ISSN
0014-7672

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๐Ÿ“œ SIMILAR VOLUMES

Calculation of dipole moments of some he
Calculation of dipole moments of some heterocyclic molecules by the CNDO molecular orbital method
โœ N.S. Hush; J.R. Yandle ๐Ÿ“‚ Article ๐Ÿ“… 1967 ๐Ÿ› Elsevier Science ๐ŸŒ English โš– 189 KB

Dipole moments of furan, pyrrole, pyridine, pyrimidind and pyridazine have been calculated by the CNDO/II approximate SCF molecular orbital method, with experimental or assumed molecular geometry. The absolute vsiues are in good agreement with experimental data.