Thomas B Rauchfuss

2024

[Ru₃(CN)₃(CO)₉]³⁻:Building Block for Multimetallic Cages

Wang, P., Zhang, Y., Woods, T. & Rauchfuss, T. B., Jan 12 2024, In: European Journal of Inorganic Chemistry. 27, 2, e202300607.

Research output: Contribution to journal › Article › peer-review

Open Access

Final Stages in the Biosynthesis of the [FeFe]-Hydrogenase Active Site

Yu, X., Rao, G., Britt, R. D. & Rauchfuss, T. B., May 27 2024, In: Angewandte Chemie International Edition. 63, 22, e202404044.

Research output: Contribution to journal › Article › peer-review

Open Access

The H-cluster of [FeFe] Hydrogenases: Its Enzymatic Synthesis and Parallel Inorganic Semisynthesis

Britt, R. D., Rauchfuss, T. B. & Rao, G., Jul 16 2024, In: Accounts of chemical research. 57, 14, p. 1941-1950 10 p.

Research output: Contribution to journal › Article › peer-review

Open Access

2023

Characterizing the Biosynthesis of the [Fe(II)(CN)(CO)₂(cysteinate)]⁻ Organometallic Product of the Radical-SAM Enzyme HydG by EPR and Mössbauer Spectroscopy

Villarreal, D. G., Rao, G., Tao, L., Liu, L., Rauchfuss, T. B. & Britt, R. D., Nov 2 2023, In: Journal of Physical Chemistry B. 127, 43, p. 9295-9302 8 p.

Research output: Contribution to journal › Article › peer-review

Fully Refined Semisynthesis of the [FeFe] Hydrogenase H-Cluster

Rao, G., Yu, X., Zhang, Y., Rauchfuss, T. B. & Britt, R. D., Oct 3 2023, In: Biochemistry. 62, 19, p. 2868-2877 10 p.

Research output: Contribution to journal › Article › peer-review

Open Access

Hybrids of [FeFe]- and [NiFe]-H₂ase Active Site Models

Zhang, F., Woods, T. J. & Rauchfuss, T. B., Jul 10 2023, In: Organometallics. 42, 13, p. 1607-1614 8 p.

Research output: Contribution to journal › Article › peer-review

Open Access

Synthesis, Spectroscopy, and Structure of [FeRu(μ-dithiolate)(CN)₂(CO)₄]^2-

Zhang, Y., Wang, P., Xue, S., Woods, T., Guo, Y., Zampella, G., Rauchfuss, T. B. & Arrigoni, F., Oct 16 2023, In: Inorganic Chemistry. 62, 41, p. 16842-16853 12 p.

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Open Access

2022

Organometallic Fe₂(μ-SH)₂(CO)₄(CN)₂Cluster Allows the Biosynthesis of the [FeFe]-Hydrogenase with only the HydF Maturase

Zhang, Y., Tao, L., Woods, T. J., Britt, R. D. & Rauchfuss, T. B., Feb 2 2022, In: Journal of the American Chemical Society. 144, 4, p. 1534-1538 5 p.

Research output: Contribution to journal › Article › peer-review

Open Access

Synthesis and Dynamics of Ferrous Polychalcogenides [Fe(E_x)(CN)₂(CO)₂]^2-(E = S, Se, or Te)

Zhang, Y., Woods, T. & Rauchfuss, T. B., May 30 2022, In: Inorganic Chemistry. 61, 21, p. 8241-8249 9 p.

Research output: Contribution to journal › Article › peer-review

Open Access

2021

Biosynthesis of the [FeFe] hydrogenase H-clusterviaa synthetic [Fe(ii)(CN)(CO)₂(cysteinate)]⁻complex

Britt, R. D. & Rauchfuss, T. B., Sep 28 2021, In: Dalton Transactions. 50, 36, p. 12386-12391 6 p.

Research output: Contribution to journal › Article › peer-review

Open Access

Challenges in the Synthesis of Active Site Mimics for [NiFe]-Hydrogenases

Basu, D., Gray, D. L., Woods, T. J., Rauchfuss, T. B., Arrigoni, F. & Zampella, G., Oct 11 2021, In: Organometallics. 40, 19, p. 3306-3312 7 p.

Research output: Contribution to journal › Article › peer-review

Open Access

Computational and Experimental Investigations of the Fe₂(μ-S₂)/Fe₂(μ-S)₂Equilibrium

Arrigoni, F., Zampella, G., Zhang, F., Kagalwala, H. N., Li, Q. L., Woods, T. J. & Rauchfuss, T. B., Mar 15 2021, In: Inorganic Chemistry. 60, 6, p. 3917-3926 10 p.

Research output: Contribution to journal › Article › peer-review

Open Access

CO substitution by PPh₃in Fe₂S₂(CO)₆proceeds via a novel Fe₂S intermediate

Zhang, F., Woods, T. J., Rauchfuss, T. B., Arrigoni, F. & Zampella, G., May 21 2021, In: Chemical Communications. 57, 41, p. 5079-5081 3 p.

Research output: Contribution to journal › Article › peer-review

Open Access

Crystal Structure of the [FeFe]-Hydrogenase Maturase HydE Bound to Complex-B

Rohac, R., Martin, L., Liu, L., Basu, D., Tao, L., Britt, R. D., Rauchfuss, T. B. & Nicolet, Y., Jun 9 2021, In: Journal of the American Chemical Society. 143, 22, p. 8499-8508 10 p.

Research output: Contribution to journal › Article › peer-review

Open Access

Homoleptic Rhodium Pyridine Complexes for Catalytic Hydrogen Oxidation

Zhang, Y., Woods, T. J. & Rauchfuss, T. B., Jul 14 2021, In: Journal of the American Chemical Society. 143, 27, p. 10065-10069 5 p.

Research output: Contribution to journal › Article › peer-review

Inhibition of [FeFe]-hydrogenase by formaldehyde: Proposed mechanism and reactivity of FeFe alkyl complexes

Zhang, F., Woods, T. J., Zhu, L. & Rauchfuss, T. B., Dec 21 2021, In: Chemical Science. 12, 47, p. 15673-15681 9 p.

Research output: Contribution to journal › Article › peer-review

Open Access

Surprising Condensation Reactions of the Azadithiolate Cofactor

Zhang, F., Richers, C. P., Woods, T. J. & Rauchfuss, T. B., Sep 13 2021, In: Angewandte Chemie - International Edition. 60, 38, p. 20744-20747 4 p.

Research output: Contribution to journal › Article › peer-review

Vibrational Perturbation of the [FeFe] Hydrogenase H-Cluster Revealed by ¹³C²H-ADT Labeling

Pelmenschikov, V., Birrell, J. A., Gee, L. B., Richers, C. P., Reijerse, E. J., Wang, H., Arragain, S., Mishra, N., Yoda, Y., Matsuura, H., Li, L., Tamasaku, K., Rauchfuss, T. B., Lubitz, W. & Cramer, S. P., Jun 9 2021, In: Journal of the American Chemical Society. 143, 22, p. 8237-8243 7 p.

Research output: Contribution to journal › Article › peer-review

Open Access

2020

Application of Hemilabile Ligands to "at-Metal Switching" Hydrogenation Catalysis

Zhang, Y., Woods, T. J. & Rauchfuss, T. B., Oct 12 2020, In: Organometallics. 39, 19, p. 3602-3612 11 p.

Research output: Contribution to journal › Article › peer-review

Radical SAM Enzyme HydE Generates Adenosylated Fe(I) Intermediates En Route to the [FeFe]-Hydrogenase Catalytic H-Cluster

Tao, L., Pattenaude, S. A., Joshi, S., Begley, T. P., Rauchfuss, T. B. & Britt, R. D., Jun 17 2020, In: Journal of the American Chemical Society. 142, 24, p. 10841-10848 8 p.

Research output: Contribution to journal › Article › peer-review

Open Access

Reactions of [Fe₆C(CO)₁₄(S)]²^–: Cluster Growth, Redox, Sulfiding

Liu, L., Woods, T. J. & Rauchfuss, T. B., Sep 30 2020, In: European Journal of Inorganic Chemistry. 2020, 36, p. 3460-3465 6 p.

Research output: Contribution to journal › Article › peer-review

Open Access

Spectroscopic and Computational Evidence that [FeFe] Hydrogenases Operate Exclusively with CO-Bridged Intermediates

Birrell, J. A., Pelmenschikov, V., Mishra, N., Wang, H., Yoda, Y., Tamasaku, K., Rauchfuss, T. B., Cramer, S. P., Lubitz, W. & Debeer, S., Jan 8 2020, In: Journal of the American Chemical Society. 142, 1, p. 222-232 11 p.

Research output: Contribution to journal › Article › peer-review

Open Access

Using nature's blueprint to expand catalysis with Earth-abundant metals

Bullock, R. M., Che, J. G., Gagliardi, L., Chiri, P. J., Farh, O. K., Hendo, C. H., Jone, C. W., Keit, J. A., Klosin, J., Mintee, S. D., Morri, R. H., Radosevic, A. T., Rauchfus, T. B., Strotma, N. A., Vojvodic, A., War, T. R., Yan, J. Y. & Surendranath, Y., Aug 14 2020, In: Science. 369, 6505, eabc3183.

Research output: Contribution to journal › Article › peer-review

Open Access

2019

Asymmetry in the Ligand Coordination Sphere of the [FeFe] Hydrogenase Active Site Is Reflected in the Magnetic Spin Interactions of the Aza-propanedithiolate Ligand

Reijerse, E. J., Pelmenschikov, V., Birrell, J. A., Richers, C. P., Kaupp, M., Rauchfuss, T. B., Cramer, S. P. & Lubitz, W., Nov 7 2019, In: Journal of Physical Chemistry Letters. 10, 21, p. 6794-6799 6 p.

Research output: Contribution to journal › Article › peer-review

Open Access

The binuclear cluster of [FeFe] hydrogenase is formed with sulfur donated by cysteine of an [Fe(Cys)(CO)₂(CN)] organometallic precursor

Rao, G., Pattenaude, S. A., Alwan, K., Blackburn, N. J., Britt, R. D. & Rauchfuss, T. B., Oct 15 2019, In: Proceedings of the National Academy of Sciences of the United States of America. 116, 42, p. 20850-20855 6 p.

Research output: Contribution to journal › Article › peer-review

Open Access

2018

A [RuRu] Analogue of an [FeFe]-Hydrogenase Traps the Key Hydride Intermediate of the Catalytic Cycle

Sommer, C., Richers, C. P., Lubitz, W., Rauchfuss, T. B. & Reijerse, E. J., May 4 2018, In: Angewandte Chemie - International Edition. 57, 19, p. 5429-5432 4 p.

Research output: Contribution to journal › Article › peer-review

Electron-Rich, Diiron Bis(monothiolato) Carbonyls: C-S Bond Homolysis in a Mixed Valence Diiron Dithiolate

Li, Q., Lalaoui, N., Woods, T. J., Rauchfuss, T. B., Arrigoni, F. & Zampella, G., Apr 16 2018, In: Inorganic Chemistry. 57, 8, p. 4409-4418 10 p.

Research output: Contribution to journal › Article › peer-review

Fe and Co Complexes of Rigidly Planar Phosphino-Quinoline-Pyridine Ligands for Catalytic Hydrosilylation and Dehydrogenative Silylation

Basu, D., Gilbert-Wilson, R., Gray, D. L., Rauchfuss, T. B. & Dash, A. K., Aug 27 2018, In: Organometallics. 37, 16, p. 2760-2768 9 p.

Research output: Contribution to journal › Article › peer-review

Ni(ii) complexes of the phosphine-oxime Ph₂PC₆H₄-2-CH=NOH

Basu, D., Woods, T. J. & Rauchfuss, T. B., 2018, In: Dalton Transactions. 47, 21, p. 7256-7262 7 p.

Research output: Contribution to journal › Article › peer-review

Sterically Stabilized Terminal Hydride of a Diiron Dithiolate

Carlson, M. R., Gray, D. L., Richers, C. P., Wang, W., Zhao, P. H., Rauchfuss, T. B., Pelmenschikov, V., Pham, C. C., Gee, L. B., Wang, H. & Cramer, S. P., Feb 19 2018, In: Inorganic Chemistry. 57, 4, p. 1988-2001 14 p.

Research output: Contribution to journal › Article › peer-review

Open Access

2017

Characterization of a borane σ complex of a diiron dithiolate: Model for an elusive dihydrogen adduct

Lalaoui, N., Woods, T., Rauchfuss, T. B. & Zampella, G., Jun 12 2017, In: Organometallics. 36, 11, p. 2054-2057 4 p.

Research output: Contribution to journal › Article › peer-review

Diiron Dithiolate Hydrides Complemented with Proton-Responsive Phosphine–Amine Ligands

Carlson, M. R., Gilbert-Wilson, R., Gray, D. R., Mitra, J., Rauchfuss, T. B. & Richers, C. P., 2017, In: European Journal of Inorganic Chemistry. 2017, 25, p. 3169-3173 5 p.

Research output: Contribution to journal › Article › peer-review

Open Access

Direct Observation of an Iron-Bound Terminal Hydride in [FeFe]-Hydrogenase by Nuclear Resonance Vibrational Spectroscopy

Reijerse, E. J., Pham, C. C., Pelmenschikov, V., Gilbert-Wilson, R., Adamska-Venkatesh, A., Siebel, J. F., Gee, L. B., Yoda, Y., Tamasaku, K., Lubitz, W., Rauchfuss, T. B. & Cramer, S. P., Mar 29 2017, In: Journal of the American Chemical Society. 139, 12, p. 4306-4309 4 p.

Research output: Contribution to journal › Article › peer-review

Interplay between terminal and bridging diiron hydrides in neutral and oxidized states

Yu, X., Tung, C. H., Wang, W., Huynh, M. T., Gray, D. L., Hammes-Schiffer, S. & Rauchfuss, T. B., Jun 12 2017, In: Organometallics. 36, 11, p. 2245-2253 9 p.

Research output: Contribution to journal › Article › peer-review

Open Access

Reaction Coordinate Leading to H₂ Production in [FeFe]-Hydrogenase Identified by Nuclear Resonance Vibrational Spectroscopy and Density Functional Theory

Pelmenschikov, V., Birrell, J. A., Pham, C. C., Mishra, N., Wang, H., Sommer, C., Reijerse, E., Richers, C. P., Tamasaku, K., Yoda, Y., Rauchfuss, T. B., Lubitz, W. & Cramer, S. P., Nov 22 2017, In: Journal of the American Chemical Society. 139, 46, p. 16894-16902 9 p.

Research output: Contribution to journal › Article › peer-review

Syntheses of transition metal methoxysiloxides

Richers, C. P., Bertke, J. A. & Rauchfuss, T. B., 2017, In: Dalton Transactions. 46, 27, p. 8756-8762 7 p.

Research output: Contribution to journal › Article › peer-review

Synthetic Models for Nickel-Iron Hydrogenase Featuring Redox-Active Ligands

Schilter, D., Gray, D. L., Fuller, A. L. & Rauchfuss, T. B., 2017, In: Australian Journal of Chemistry. 70, 5, p. 505-515 11 p.

Research output: Contribution to journal › Article › peer-review

Open Access

2016

Cobalt Phosphino-α-Iminopyridine-Catalyzed Hydrofunctionalization of Alkenes: Catalyst Development and Mechanistic Analysis

Chu, W. Y., Gilbert-Wilson, R., Rauchfuss, T. B., Van Gastel, M. & Neese, F., Sep 12 2016, In: Organometallics. 35, 17, p. 2900-2914 15 p.

Research output: Contribution to journal › Article › peer-review

Open Access

Preparation and Protonation of Fe₂(pdt)(CNR)₆, Electron-Rich Analogues of Fe₂(pdt)(CO)₆

Zhou, X., Barton, B. E., Chambers, G. M., Rauchfuss, T. B., Arrigoni, F. & Zampella, G., Apr 4 2016, In: Inorganic Chemistry. 55, 7, p. 3401-3412 12 p.

Research output: Contribution to journal › Article › peer-review

Rational Synthesis of the Carbonyl(perthiolato)diiron [Fe2(S3CPh2)(CO)6] and Related Complexes

Zhao, P., Gray, D. L. & Rauchfuss, T. B., Jun 2016, In: European Journal of Inorganic Chemistry. 2016, 17, p. 2681-2683 3 p.

Research output: Contribution to journal › Article › peer-review

Open Access

2015

Cooperative metal-ligand reactivity and catalysis in low-spin ferrous alkoxides

Chu, W. Y., Zhou, X. & Rauchfuss, T. B., May 11 2015, In: Organometallics. 34, 9, p. 1619-1625 7 p.

Research output: Contribution to journal › Article › peer-review

Crystal structure of [μ₂-3,3-dimethyl-4-(propan-2-ylidene)thietane-2,2-dithiolato-κ⁴ S:S′:S:S′]bis[tricarbonyliron(I)](Fe - Fe)

Zhao, P., Bertke, J. A. & Rauchfuss, T. B., 2015, In: Acta Crystallographica Section E: Crystallographic Communications. 71, p. 1296-1299 4 p.

Research output: Contribution to journal › Article › peer-review

Open Access

Crystal structure of bis(acetylacetonato-κ²O,O′)(tetrahydrofuran-κO)(trifluoromethanesulfonato-κO)iron(III)

Richers, C. P., Bertke, J. A. & Rauchfuss, T. B., 2015, In: Acta Crystallographica Section E: Crystallographic Communications. 71, p. 1165-1168 4 p.

Research output: Contribution to journal › Article › peer-review

Open Access

Thomas B Rauchfuss

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