Magnetic Inequivalence

Magnetic Inequivalence can occur within sets of chemically equivalent nuclei

  • For two nuclei that are chemically equivalent to be magnetically equivalent, they must couple in the same fashion to all other magnetic nuclei in the molecule.
  • Nuclei are magnetically inequivalent to each other if they couple differently to at least one other magnetic nucleus in the molecule.

    Viewing tools:

    The Example: The following pair of protons are chemically equivalent because they are equivalent through a C2 operation
    If we differentiate between the two Ha protons and label them
    And use to test Ha1 and Ha2 against
    We ask the following question:
    If the two Ha protons are magnetically equivalent, they will each couple to Hb in the same fashion.
    This is clearly not the case: Ha1 couples to Hb in a geminal (adjacent to each other on the same carbon atom: Ha1 - C - Hb) relationship
    However Ha2 couples to Hb in a viscinal relationship (Ha2- C - C - Hb)

    We conclude that Ha1 and Ha2 are magnetically inequivalent
    and by convention we label them Ha and Ha'

    Your mission: Test to see if the
    1. protons are magnetically equivalent to each other
    2. And if within the Hc subset and the Hd subset of protons you expect to see magnetic inequivalence

    Reference: CCDC Structure HARBAD; R.J. Geve, L.M. Englehardt, J. M. Harrowfield
    A.M. Sargenson, A. H. White Aust. J. Chem. Vol 46, 1993, p. 1485


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