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Tetraarylcyclobutadiene­cyclopentadienyl­cobalt Complexes: Synthesis, Electronic Spectra, Magnetic Circular Dichroism, Linear Dichroism, and TD DFT Calculations

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posted on 2014-07-14, 00:00 authored by Gregg S. Kottas, Thierry Brotin, Peter F. H. Schwab, Kamal Gala, Zdeněk Havlas, James P. Kirby, John R. Miller, Josef Michl
The known (tetraphenyl-η4-cyclobutadiene)-η5-cyclopentadienylcobalt (1) and a series of its new substituted derivatives have been prepared. The electronic states of a few representatives have been characterized by absorption and magnetic circular dichroism. Time-dependent density functional theory has been used to arrive at spectral assignments for several prominent low-energy bands. The absorption spectra of the radical ions of 1 have also been recorded.

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