Nuclear magnetic resonance studies. XV. Conformational free energy of the formyl group
作者:
G. W. Buchanan,
J. B. Stothers,
Siu-Tzyy Wu,
期刊:
Canadian Journal of Chemistry
(NRC Available online 1967)
卷期:
Volume 45,
issue 23
页码: 2955-2961
ISSN:0008-4042
年代: 1967
DOI:10.1139/v67-477
出版商: NRC Research Press
数据来源: NRC
摘要:
Proton spectroscopy has been employed to determine the conformational free energy (− ΔG0) of a formyl group bonded to a cyclohexane ring. Thecis- andtrans-4-t-butylderivatives were used as models for the axial and equatorial formyl groups in cyclohexanecarboxaldehyde and 1-methylcyclohexanecarboxaldehyde. The wiggle-beat technique was used to determine the spectral line positions and separations because of the relatively small differences involved. The − ΔG0values were found to be relatively insensitive to solvent polarity and concentration over the range 10–50 mole %. For 10 mole % solutions the average value of − ΔG0CHOwas found to be 1.38 kcal/mole.
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