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Some effects of intramolecular hydrogen bonding on vibrational spectra

✍ Scribed by V.M. Schreiber

Publisher
Elsevier Science
Year
1989
Tongue
English
Weight
559 KB
Volume
197
Category
Article
ISSN
0022-2860

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## Abstract An __ab initio__ study of 3‐chloro‐, 3‐hydroxy‐, 3‐mercapto‐, and 3‐amino‐propanenitrile and 4‐chloro‐bu‐ tanenitrile was carried out at several levels of theory. The calculated stabilities and geometrical trends are interpreted in terms of the effects of intramolecular hydrogen bonds a