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Theoretical study of Mills-Nixon effect in naphthocyclobutenes and -cyclobutadienes

✍ Scribed by M. Hodošček; D. Kovaček; Z. B. Maksić


Book ID
105083393
Publisher
Springer
Year
1993
Tongue
English
Weight
544 KB
Volume
86
Category
Article
ISSN
1432-2234

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AMI semiempirical calculations, both AH and AS, were carried out on the enol/enol tautomerism of 2513-diketones and 813-ketoaldehydes. In the first case, q~AGex p was determined by Hansen (Magn. Reson. Chem. 1996, 34,467) and his values correlate reasonably well with 8AGcalc, 8AGexp = -0.23 + 0.29 8