Acetaldehyde-ammonia interaction: a DFT study of reaction mechanism and product identification

The product of acetaldehyde and ammonia reaction, namely, 2,4,6-trimethyl-1,3,5-hexahydrotriazine trihydrate, was synthesized and identified using a combination of experimental (NMR spectroscopy, IR spectroscopy, melting point determination) and DFT-based theoretical approaches. A reaction mechanism...

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Bibliographic Details
Published in:The Journal of Physical Chemistry A Vol. 121, № 16. P. 3136-3141
Other Authors: Fateev, Alexander V., Malkov, Victor S., Tuguldurova, Vera P., Vodyankina, Olga V.
Format: Article
Language:English
Subjects:
Online Access:http://vital.lib.tsu.ru/vital/access/manager/Repository/vtls:000616039
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