A new chapter in the organometallic porphyrin story

Jeffery William Seyler, Purdue University

Abstract

Metalloporphyrins comprise the prosthetic group of numerous metalloproteins, such as cytochromes, hemoglobin, and certain photosynthetic proteins. This biological relevance has resulted in a long and colorful history to metalloporphyrin chemistry. We have selected organometallic Ru porphyrin complexes as model compounds for the Fe-carbon and N-carbon bonded species formed in reactions of cytochrome P-450. The complexes of Ru(OEP)R$\sb{\rm n}$ (n = 1, 2 and R = methyl, p-X-C$\sb6$H$\sb4$, and C$\sb6$F$\sb5$) have been studied using electrochemical, chemical, and spectroscopic methods. These studies reveal the oxidation state-dependent stability for the various $\sigma$-bonded R groups. Cyclic voltammetry of Ru(OEP) (Ar)$\sb2$ in THF reveals two reversible reductions and one irreversible oxidation. The first reduction is chemically reversible, while the second reduction is coupled to loss of aryl$\sp-$ on the cyclic voltammetric time scale. The oxidation is irreversible due to a rapid Ru-to-N aryl migration. (Ru(OEP-N-C$\sb6$H$\sb5$) (C$\sb6$H$\sb5$)) (BF$\sb4$) has been crystallographically characterized. Voltammetry at 10 kV/s captures the Ru(OEP(Ar)$\sb2\sp+$ species and provides a measure of its lifetime on the order of $\mu$s. The voltammetry of Ru(OEP)(Ar) complexes reveal a reversible oxidation and a reversible reduction. These electrochemical observations of the Ru(OEP)(Ar)$\sb{\rm n}$ complexes were verified using sodium naphthalenide as a chemical reductant and AgBF$\sb4$ as a chemical oxidant. The $\sp1$H NMR spectra of mixtures of neutral and ionic species reveal rapid electron self-exchange. These physical measurements have been extended to the analogous Ru(OEP)(CH$\sb3$)$\sb{\rm n}$ complexes. Ru(OEP)(CH$\sb3$)$\sb2$ exhibits irreversible oxidations and reductions; here the first reduction results in loss of $\cdot$CH$\sb3$. The initial oxidation product, Ru(OEP)(CH$\sb3$)$\sb2\sp+$, rapidly N-methylates and further reacts to a bridging methylene product, (Ru(OEP-N-$\mu$-CH$\sb2$) (CH$\sb3$)) (BF$\sb4$), confirmed by an X-ray crystal structure. The mono-CH$\sb3$ complex shows the same redox chemistry as observed with the mono-aryls. A combination, at least conceptually, of these two classes of Ru(OEP)R$\sb{\rm n}$ complexes lies in the Ru(OEP)(C$\sb6$H$\sb5$)(CH$\sb3$) complex, synthesized from Ru(OEP)(C$\sb6$H$\sb5$)$\sp-$ and CH$\sb3$I. This mixed aryl-alkyl complex is the first example of an aryl-alkyl porphyrin complex. The Ru(OEP) (C$\sb6$H$\sb5$)(CH$\sb3$) complex thermally decomposes via Ru-CH$\sb3$ bond homolysis, thus providing the opportunity to measure the Ru-C bond energy, 26.5 kcal/mol, a quantity of considerable interest within the field.

Degree

Ph.D.

Advisors

Leidner, Purdue University.

Subject Area

Chemistry

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