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A Computational Experiment of the Endo versus Exo Preference in a Diels–Alder Reaction

✍ Scribed by Rowley, Christopher N.; Woo, Tom K.; Mosey, Nick J.

Book ID
120428632
Publisher
American Chemical Society
Year
2009
Tongue
English
Weight
219 KB
Volume
86
Category
Article
ISSN
0021-9584

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endo-exo Selectivity in Diels-Alder cycloadditions of several o-quinodimethanes (1-4) with acrylonitrile, 2-(5H)-furanone and N-methylmaleimide has been investigated in acetonitrile solution. Transition structures of the cycloaddition of the parent o-QDM (1), (E,E)-1,8-dimethyl-o-QDM (2), isoindene