Chinese Journal of Magnetic Resonance ›› 1989, Vol. 6 ›› Issue (2): 201-208.

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A STUDY OF RELATIONSHIP BETWEEN THE STRUCTURE OF CUPPERIC COMPOUNDS AND THEIR ESR TENSORS

Lin Qingsong   

  1. Department of Chemistry Dalian University of Technology, Dalian China
  • Received:1988-01-19 Revised:1988-05-25 Published:1989-06-05 Online:2018-01-22

Abstract: A linear correlation of g and A of cupric ion were found for some copper compounds of particular ligands. Relationships between the correlation and structures of coppercontaining compounds have been examined. It is indicated that the relation is concerned with molecular symmetry and properties of a bonding molecular orbit. It is shown that a higher symmetry and a lower covalency of the copper-ligand bondings result in increasing of g and decreasing of A absolute value. It is also shown that there is a linear relation between g vs. β12 and A vs. β12, respectively, for some Cu (Ⅱ)-compounds. By means of experimental values of gand A, an empirical method used to estimate approximate values of β12 in molecular orbital coefficients is introduced.

Key words: ESR, cupric compound, molecular orbital coefficient zeolite