Scalar coupling constants

IntroductionJ-couplingsChemical shiftsHydroxy methyl

Coupling constants related to the ω torsion

Equations describing the couplings related to the O5-C5-C6-O6 (ω) torsion in hexopyranoses as decribed by Stenutz et al.. (θ is the C5-C6-O6-O6H torsion)

"Hydroxymethyl Group Conformation in Saccharides: Structural Dependence of 2JHH, 3JHH,and 1JCH Spin-Spin Coupling Constants"
R. Stenutz, I. Carmichael, G. Widmalm & A.S. Serianni; J. Org. Chem. 67 (2002) 949-958.
"Correlated C-C and C-O bond conformations in saccharide hydroxymethyl groups: parametrization and application of redundant 1H-1H, 13C-1H, and 13C-1C NMR J-couplings"
C. Thibaudeau, R. Stenutz, B. Hertz, T. Klepach, S. Zhao, Q. Wu, I. Carmichael & A.S. Serianni; J. Am. Chem. Soc. 126 (2004) 15668-15685.

ω=   θ=  
JC,C
1JC5,C6=
2JC4,C6=
JC,H
1JC6,H6R=   1JC6,H6S=
2JC5,H6R=   2JC5,H6S=   2JC6,H5=
3JC4,H6R=   3JC4,H6S=
JH,H
2JH6R,H6S=
3JH5,H6R=   3JH5,H6S=
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