Simulation of the Electron Paramagnetic Resonance Spectrum of the Triplet Ground State Dimer Di-μ-(Pyridine N-Oxide)Bis[Bisnitrato(Pyridine N-Oxide)Copper(II)]

Abstract The EPR spectrum of the triplet ground state dimer di-μ-(pyridine N-oxide)bis[bisnitrato(pyridine N-oxide)copper(II)] has been reported recently1. Of the very few triplet ground state copper(II) dimers with resolved metal hyperfine structure2,3, the EPR spectrum of this complex is most complete. Previously, the analysis of the spectra of triplet ground state copper(II) complexes, in order to extract magnetic parameters, has been made using the equations reported by Wasserman et al.4 The best magnetic parameters should be obtained from a simulation of the experimental spectrum. We wish to report here the computer simulation of the EPR spectrum of a powdered sample of [Cu(II) (PYO)2 (NO3)2]2.