AM1 method study of the thermolyses of aryl t-butylamines
The thermolyses of N- t-butylaniline, N- t-butyl- p-anisidine and N- t-butyl- p-nitroaniline have been investigated using the AM1 molecular orbital method. The results obtained show that these compounds are thermally decomposed into isobutylene and arylamines through a unimolecular elimination invol...
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Published in | Journal of molecular structure. Theochem Vol. 336; no. 1; pp. 85 - 90 |
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Main Authors | , |
Format | Journal Article |
Language | English |
Published |
Elsevier B.V
20.06.1995
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Online Access | Get full text |
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Summary: | The thermolyses of
N-
t-butylaniline,
N-
t-butyl-
p-anisidine and
N-
t-butyl-
p-nitroaniline have been investigated using the AM1 molecular orbital method. The results obtained show that these compounds are thermally decomposed into isobutylene and arylamines through a unimolecular elimination involving polar four-center cyclic transition states. |
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ISSN: | 0166-1280 1872-7999 |
DOI: | 10.1016/0166-1280(95)91279-H |