Abstract

Bulky pyrrolyl ligands have been used for the synthesis of diazaferrocenes, which have been characterized by various spectroscopic techniques, including X-ray diffraction for <i>rac</i>-[{η<sup>5</sup>-2,3,5-(Me<sub>3</sub>C)<sub>3</sub>C<sub>4</sub>HN}<sub>2</sub>Fe]. Chemical oxidation of diazaferrocenes to the corresponding diazaferrocenium cations has been accomplished with AgSbF<sub>6</sub>. In addition, EPR and Mössbauer spectroscopic, electrochemical, and density function theory (DFT) studies have provided a more detailed understanding of the electronic structures of these complexes

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