DFT and NMR Studies of 2JCOH, 3JHCOH, and 3JCCOH Spin-Couplings in Saccharides: C−O Torsional Bias and H-Bonding in Aqueous Solution
Author:
Affiliation:
1. Department of Chemistry and Biochemistry and the Radiation Laboratory, University of Notre Dame, Notre Dame, Indiana 46556-5670
Publisher
American Chemical Society (ACS)
Subject
Organic Chemistry
Link
https://pubs.acs.org/doi/pdf/10.1021/jo0619884
Reference46 articles.
1. Interpretation of the Electron‐Spin Resonance Spectrum of the Methyl Radical
2. CONFIGURATIONAL EFFECTS IN THE PROTON MAGNETIC RESONANCE SPECTRA OF ACETYLATED CARBOHYDRATES1
3. Calculation of nuclear spin-spin couplings IX. Vicinal proton-proton coupling constants in methanol and methylamine
4. Karplus-type relationships between scalar coupling constants: 3 J HH molecular versus 4h J HH supramolecular coupling constants
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