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Conformations of furan-, pyrrole-, and pyridine-carbaldehydes: an ab initio molecular orbital study

โœ Scribed by John, Ian G.; Ritchie, Geoffrey L. D.; Radom, Leo


Book ID
121449979
Publisher
Royal Society of Chemistry
Year
1977
Tongue
English
Weight
817 KB
Volume
12
Category
Article
ISSN
1472-779X

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Conformational analysis of allylamine. A
โœ James Kao; Jeffrey I. Seeman ๐Ÿ“‚ Article ๐Ÿ“… 1984 ๐Ÿ› John Wiley and Sons ๐ŸŒ English โš– 575 KB

The conformational characteristics of allylamine were investigated by the ab initio STO-~G basis set. The results indicate that the molecule exists in a number of stable conformations through rotations about the CC-NH and CC-CN bonds. The TE ( &u~-CCNLP, LP representing lone-pair electrons, and ecli