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  • Larry Que
2017

Spectroscopic and Reactivity Comparisons of a Pair of bTAML Complexes with FeV=O and FeIV=O Units

Pattanayak, S., Jasniewski, A. J., Rana, A., Draksharapu, A., Singh, K. K., Weitz, A., Hendrich, M., Que, L., Dey, A. & Sen Gupta, S., Jun 5 2017, In : Inorganic chemistry. 56, 11, p. 6352-6361 10 p.

Research output: Contribution to journalArticle

Open Access
19 Scopus citations

Direct photochemical actIVation of non-heme Fe(IV)O complexes

Chen, J., Draksharapu, A., Harvey, E., Rasheed, W., Que, L. & Browne, W. R., Jan 1 2017, In : Chemical Communications. 53, 91, p. 12357-12360 4 p.

Research output: Contribution to journalArticle

8 Scopus citations

Unprecedented (μ-1,1-Peroxo)diferric Structure for the Ambiphilic Orange Peroxo Intermediate of the Nonheme N-Oxygenase CmlI

Jasniewski, A. J., Komor, A. J., Lipscomb, J. D. & Que, L., Aug 2 2017, In : Journal of the American Chemical Society. 139, 30, p. 10472-10485 14 p.

Research output: Contribution to journalArticle

Open Access
11 Scopus citations
2015

Caught! Crystal trapping of a side-on peroxo bound to Cr(IV)

De Sousa, D. P., Bigelow, J. O., Sundberg, J., Que, L. & McKenzie, C. J., Feb 18 2015, In : Chemical Communications. 51, 14, p. 2802-2805 4 p.

Research output: Contribution to journalArticle

13 Scopus citations
2016

A Carboxylate Shift Regulates Dioxygen Activation by the Diiron Nonheme β-Hydroxylase CmlA upon Binding of a Substrate-Loaded Nonribosomal Peptide Synthetase

Jasniewski, A. J., Knoot, C., Lipscomb, J. D. & Que, L., Oct 18 2016, In : Biochemistry. 55, 41, p. 5818-5831 14 p.

Research output: Contribution to journalArticle

Open Access
5 Scopus citations
3 Scopus citations
2015

Oxoiron(IV) Complex of the Ethylene-Bridged Dialkylcyclam Ligand Me2EBC

England, J., Prakash, J., Cranswick, M. A., Mandal, D., Guo, Y., Münck, E., Shaik, S. & Que, L., Aug 17 2015, In : Inorganic Chemistry. 54, 16, p. 7828-7839 12 p.

Research output: Contribution to journalArticle

14 Scopus citations
2017

Oxoiron(IV) Tetramethylcyclam Complexes with Axial Carboxylate Ligands: Effect of Tethering the Carboxylate on Reactivity

Bigelow, J. O., England, J., Klein, J. E. M. N., Farquhar, E. R., Frisch, J. R., Martinho, M., Mandal, D., Münck, E., Shaik, S. & Que, L., Mar 20 2017, In : Inorganic chemistry. 56, 6, p. 3287-3301 15 p.

Research output: Contribution to journalArticle

12 Scopus citations
2015

Toward the Synthesis of More Reactive S = 2 Non-Heme Oxoiron(IV) Complexes

Puri, M. & Que, L., Jul 15 2015, In : Accounts of Chemical Research. 48, 8, p. 2443-2452 10 p.

Research output: Contribution to journalArticle

118 Scopus citations

Synthetic models of 2-oxoglutarate-dependent oxygenases

Allpress, C. J., Kleespies, S. T. & Que, L., Jan 1 2015, 2-Oxoglutarate-Dependent Oxygenases. Hausinger, R. P. & Schofield, C. J. (eds.). 3 ed. Royal Society of Chemistry, p. 123-148 26 p. (RSC Metallobiology; vol. 2015-January, no. 3).

Research output: Chapter in Book/Report/Conference proceedingChapter

2 Scopus citations
2017

Characterization of the Fleeting Hydroxoiron(III) Complex of the Pentadentate TMC-py Ligand

Ching, W. M., Zhou, A., Klein, J. E. M. N., Fan, R., Knizia, G., Cramer, C. J., Guo, Y. & Que, L., Jan 1 2017, In : Inorganic chemistry. 56, 18, p. 11129-11140 12 p.

Research output: Contribution to journalArticle

14 Scopus citations

Mimicking Class I b Mn2-Ribonucleotide Reductase: A MnII2 Complex and Its Reaction with Superoxide

Magherusan, A. M., Zhou, A., Farquhar, E. R., García-Melchor, M., Twamley, B., Que, L. & McDonald, A. R., Jan 22 2018, In : Angewandte Chemie - International Edition. 57, 4, p. 918-922 5 p.

Research output: Contribution to journalArticle

Open Access
9 Scopus citations

Crystallographic Evidence for a Sterically Induced Ferryl Tilt in a Non-Heme Oxoiron(IV) Complex that Makes it a Better Oxidant

Rasheed, W., Draksharapu, A., Banerjee, S., Young, V. G., Fan, R., Guo, Y., Ozerov, M., Nehrkorn, J., Krzystek, J., Telser, J. & Que, L., Jul 20 2018, In : Angewandte Chemie - International Edition. 57, 30, p. 9387-9391 5 p.

Research output: Contribution to journalArticle

19 Scopus citations
2015

Reactivity and O2 Formation by Mn(IV)- and Mn(V)-Hydroxo Species Stabilized within a Polyfluoroxometalate Framework

Schreiber, R. E., Cohen, H., Leitus, G., Wolf, S. G., Zhou, A., Que, L. & Neumann, R., Jul 15 2015, In : Journal of the American Chemical Society. 137, 27, p. 8738-8748 11 p.

Research output: Contribution to journalArticle

19 Scopus citations
2017
63 Scopus citations
2015

Modeling TauD- J: A high-spin nonheme oxoiron(IV) complex with high reactivity toward C-H bonds

Biswas, A. N., Puri, M., Meier, K. K., Oloo, W. N., Rohde, G. T., Bominaar, E. L., Münck, E. & Que, L., Feb 25 2015, In : Journal of the American Chemical Society. 137, 7, p. 2428-2431 4 p.

Research output: Contribution to journalArticle

71 Scopus citations
2017

Facile and Reversible Formation of Iron(III)–Oxo–Cerium(IV) Adducts from Nonheme Oxoiron(IV) Complexes and Cerium(III)

Draksharapu, A., Rasheed, W., Klein, J. E. M. N. & Que, L., Jan 1 2017, In : Angewandte Chemie - International Edition. 56, 31, p. 9091-9095 5 p.

Research output: Contribution to journalArticle

Open Access
15 Scopus citations
2018
Open Access
15 Scopus citations
2017

Hydrogen-Atom Transfer Oxidation with H2O2 Catalyzed by [FeII(1,2-bis(2,2′-bipyridyl-6-yl)ethane(H2O)2]2+: Likely Involvement of a (μ-Hydroxo)(μ-1,2-peroxo)diiron(III) Intermediate

Khenkin, A. M., Vedichi, M., Shimon, L. J. W., Cranswick, M. A., Klein, J. E. M. N., Que, L. & Neumann, R., Nov 2017, In : Israel Journal of Chemistry. 57, 10, p. 990-998 9 p.

Research output: Contribution to journalArticle

Open Access
2016

Spectroscopic and Theoretical Study of Spin-Dependent Electron Transfer in an Iron(III) Superoxo Complex

Stout, H. D., Kleespies, S. T., Chiang, C. W., Lee, W. Z., Que, L., Münck, E. & Bominaar, E. L., Jun 6 2016, In : Inorganic Chemistry. 55, 11, p. 5215-5226 12 p.

Research output: Contribution to journalArticle

7 Scopus citations
2015

An unusual peroxo intermediate of the arylamine oxygenase of the chloramphenicol biosynthetic pathway

Makris, T. M., Vu, V. V., Meier, K. K., Komor, A. J., Rivard, B. S., Münck, E., Que, L. & Lipscomb, J. D., Feb 4 2015, In : Journal of the American Chemical Society. 137, 4, p. 1608-1617 10 p.

Research output: Contribution to journalArticle

36 Scopus citations
2016

Why metal-oxos react with dihydroanthracene and cyclohexadiene at comparable rates, despite having different C-H bond strengths. A computational study

Klein, J. E. M. N., Dereli, B., Que, L. & Cramer, C., Jan 1 2016, In : Chemical Communications. 52, 69, p. 10509-10512 4 p.

Research output: Contribution to journalArticle

Open Access
9 Scopus citations
2017

CmlI N-Oxygenase Catalyzes the Final Three Steps in Chloramphenicol Biosynthesis without Dissociation of Intermediates

Komor, A. J., Rivard, B. S., Fan, R., Guo, Y., Que, L. & Lipscomb, J. D., Sep 19 2017, In : Biochemistry. 56, 37, p. 4940-4950 11 p.

Research output: Contribution to journalArticle

Open Access
5 Scopus citations
2019

Letter from the Editor

Que, L., Dec 1 2019, In : Journal of Biological Inorganic Chemistry. 24, 8, 1 p.

Research output: Contribution to journalLetter

Open Access

NMR Reveals That a Highly Reactive Nonheme FeIV=O Complex Retains Its Six-Coordinate Geometry and S=1 State in Solution

Banerjee, S., Rasheed, W., Fan, R., Draksharapu, A., Oloo, W. N., Guo, Y. & Que, L., Jul 22 2019, In : Chemistry - A European Journal. 25, 41, p. 9608-9613 6 p.

Research output: Contribution to journalArticle

4 Scopus citations
2016

X-ray absorption spectroscopic characterization of the diferric-peroxo intermediate of human deoxyhypusine hydroxylase in the presence of its substrate eIF5a

Jasniewski, A. J., Engstrom, L. M., Vu, V. V., Park, M. H. & Que, L., Sep 1 2016, In : Journal of Biological Inorganic Chemistry. 21, 5-6, p. 605-618 14 p.

Research output: Contribution to journalArticle

Open Access
10 Scopus citations
2015

Upside Down! Crystallographic and Spectroscopic Characterization of an [FeIV(Osyn)(TMC)]2+ Complex

Prakash, J., Rohde, G. T., Meier, K. K., Münck, E. & Que, L., Nov 24 2015, In : Inorganic Chemistry. 54, 23, p. 11055-11057 3 p.

Research output: Contribution to journalArticle

20 Scopus citations
2018

Acid-Triggered O−O Bond Heterolysis of a Nonheme FeIII(OOH) Species for the Stereospecific Hydroxylation of Strong C−H Bonds

Serrano-Plana, J., Acuña-Parés, F., Dantignana, V., Oloo, W. N., Castillo, E., Draksharapu, A., Whiteoak, C. J., Martin-Diaconescu, V., Basallote, M. G., Luis, J. M., Que, L., Costas, M. & Company, A., Apr 6 2018, In : Chemistry - A European Journal. 24, 20, p. 5331-5340 10 p.

Research output: Contribution to journalArticle

Open Access
16 Scopus citations
2019

Octahedral iron(iv)-tosylimido complexes exhibiting single electron-oxidation reactivity

Sabenya, G., Gamba, I., Gómez, L., Clémancey, M., Frisch, J. R., Klinker, E. J., Blondin, G., Torelli, S., Que, L., Martin-Diaconescu, V., Latour, J. M., Lloret-Fillol, J. & Costas, M., Jan 1 2019, In : Chemical Science. 10, 41, p. 9513-9529 17 p.

Research output: Contribution to journalArticle

Open Access
2 Scopus citations
2018

Dioxygen Activation by Nonheme Diiron Enzymes: Diverse Dioxygen Adducts, High-Valent Intermediates, and Related Model Complexes

Jasniewski, A. J. & Que, L., Mar 14 2018, In : Chemical Reviews. 118, 5, p. 2554-2592 39 p.

Research output: Contribution to journalArticle

Open Access
93 Scopus citations
2019

A Mn II Mn III -Peroxide Complex Capable of Aldehyde Deformylation

Magherusan, A. M., Kal, S., Nelis, D. N., Doyle, L. M., Farquhar, E. R., Que, L. & McDonald, A. R., Apr 16 2019, In : Angewandte Chemie - International Edition. 58, 17, p. 5718-5722 5 p.

Research output: Contribution to journalArticle

2 Scopus citations
2016

HFEPR and Computational Studies on the Electronic Structure of a High-Spin Oxidoiron(IV) Complex in Solution

Bucinsky, L., Rohde, G. T., Que, L., Ozarowski, A., Krzystek, J., Breza, M. & Telser, J., May 2 2016, In : Inorganic Chemistry. 55, 8, p. 3933-3945 13 p.

Research output: Contribution to journalArticle

5 Scopus citations
2015

Characterization of a heterobimetallic nonheme Fe(III)-O-Cr(III) species formed by O2 activation

Zhou, A., Kleespies, S. T., Van Heuvelen, K. M. & Que, L., Aug 5 2015, In : Chemical Communications. 51, 76, p. 14326-14329 4 p.

Research output: Contribution to journalArticle

9 Scopus citations
17 Scopus citations
2019

Spectroscopic and Reactivity Comparisons between Nonheme Oxoiron(IV) and Oxoiron(V) Species Bearing the Same Ancillary Ligand

Dantignana, V., Serrano-Plana, J., Draksharapu, A., Magallón, C., Banerjee, S., Fan, R., Gamba, I., Guo, Y., Que, L., Costas, M. & Company, A., Sep 25 2019, In : Journal of the American Chemical Society. 141, 38, p. 15078-15091 14 p.

Research output: Contribution to journalArticle

5 Scopus citations
2015

Magnetic circular dichroism and computational study of mononuclear and dinuclear iron(iv) complexes

Ye, S., Xue, G., Krivokapic, I., Petrenko, T., Bill, E., Que, L. & Neese, F., May 1 2015, In : Chemical Science. 6, 5, p. 2909-2921 13 p.

Research output: Contribution to journalArticle

18 Scopus citations
2017

60 years of dioxygen activation

Que, L., Apr 1 2017, In : Journal of Biological Inorganic Chemistry. 22, 2-3, p. 171-173 3 p.

Research output: Contribution to journalEditorial

Open Access
13 Scopus citations
2018

On the Lewis Acidity of the Oxoiron(IV) Unit in a Tetramethylcyclam Complex

Klein, J. E. M. N., Draksharapu, A., Shokri, A., Cramer, C. & Que, L., Apr 6 2018, In : Chemistry - A European Journal. 24, 20, p. 5373-5378 6 p.

Research output: Contribution to journalArticle

4 Scopus citations
2019
4 Scopus citations
2017
7 Scopus citations
2016

Nuclear Resonance Vibrational Spectroscopic Definition of Peroxy Intermediates in Nonheme Iron Sites

Sutherlin, K. D., Liu, L. V., Lee, Y. M., Kwak, Y., Yoda, Y., Saito, M., Kurokuzu, M., Kobayashi, Y., Seto, M., Que, L., Nam, W. & Solomon, E. I., Nov 2 2016, In : Journal of the American Chemical Society. 138, 43, p. 14294-14302 9 p.

Research output: Contribution to journalArticle

Open Access
3 Scopus citations
2018

Sc 3+ (or HClO 4 ) Activation of a Nonheme Fe III -OOH Intermediate for the Rapid Hydroxylation of Cyclohexane and Benzene

Kal, S., Draksharapu, A. & Que, L., May 2 2018, In : Journal of the American Chemical Society. 140, 17, p. 5798-5804 7 p.

Research output: Contribution to journalArticle

Open Access
19 Scopus citations
2015

Erratum: Evidence for an oxygen evolving iron-oxo-cerium intermediate in iron-catalysed water oxidation (Nature Communications (2015) 6 (5865) DOI: 10.1038/ncomms6865)

Codolà, Z., Gómez, L., Kleespies, S. T., Que, L., Costas, M. & Lloret-Fillol, J., Feb 2015, In : Nature communications. 6, 6405.

Research output: Contribution to journalComment/debate

4 Scopus citations
2018

Spectroscopic and DFT Characterization of a Highly Reactive Nonheme FeV-Oxo Intermediate

Fan, R., Serrano-Plana, J., Oloo, W. N., Draksharapu, A., Delgado-Pinar, E., Company, A., Martin-Diaconescu, V., Borrell, M., Lloret-Fillol, J., García-España, E., Guo, Y., Bominaar, E. L., Que, L., Costas, M. & Münck, E., Mar 21 2018, In : Journal of the American Chemical Society. 140, 11, p. 3916-3928 13 p.

Research output: Contribution to journalArticle

31 Scopus citations
2015

Trapping a Highly Reactive Nonheme Iron Intermediate That Oxygenates Strong C-H Bonds with Stereoretention

Serrano-Plana, J., Oloo, W. N., Acosta-Rueda, L., Meier, K. K., Verdejo, B., García-España, E., Basallote, M. G., Münck, E., Que, L., Company, A. & Costas, M., Dec 23 2015, In : Journal of the American Chemical Society. 137, 50, p. 15833-15842 10 p.

Research output: Contribution to journalArticle

83 Scopus citations
2019

Carboxylate Structural Effects on the Properties and Proton-Coupled Electron Transfer Reactivity of [CuO2CR]2+ Cores

Elwell, C. E., Mandal, M., Bouchey, C. J., Que, L., Cramer, C. J. & Tolman, W. B., Dec 2 2019, In : Inorganic Chemistry. 58, 23, p. 15872-15879 8 p.

Research output: Contribution to journalArticle

1 Scopus citations
2017
Open Access
23 Scopus citations