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Directing protonation in [FeFe] hydrogenase active site models by modifications in their second coordination sphere
Salah Ezzaher1, Adolf Gogoll, Clemens Bruhn
1Department of Photochemistry and Molecular Science, Angström Laboratories, Uppsala University, Box 523, 75120 Uppsala, Sweden.
Abstract:
Subtle changes in the second coordination sphere of [Cl(2)bdtFe(2)(CO)(4)(Ph(2)P-CH(2)-X-CH(2)-PPh(2))] (bdt = benzene-1,2-dithiolate, X = NCH(3), NCH(2)CF(3), CH(2)) that do not influence the electronic character of the Fe(2) center can however direct protonation to three different sites: the N in the bis-phosphane, the Fe-Fe bond or the bdt-S.
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