Nicolai Lehnert

Overview

Best Publications

• Geometric and Electronic Structure/Function Correlations in Non-Heme Iron Enzymes

  Edward I. Solomon;Thomas C. Brunold;Mindy I. Davis;Jyllian N. Kemsley

  1999
  Citations

• Non-heme iron enzymes: Contrasts to heme catalysis

  Edward I. Solomon;Andrea Decker;Nicolai Lehnert

  302
  Citations

• Iron and manganese oxo complexes, oxo wall and beyond

  Virginia A. Larson;Beatrice Battistella;Kallol Ray;Nicolai Lehnert

  268
  Citations

• Reversing nitrogen fixation

  Nicolai Lehnert;Hai T. Dong;Jill B. Harland;Andrew P. Hunt

  265
  Citations

• Electronic Structure of Heme-Nitrosyls and Its Significance for Nitric Oxide Reactivity, Sensing, Transport, and Toxicity in Biological Systems

  Lauren E. Goodrich;Florian Paulat;V. K. K. Praneeth;Nicolai Lehnert

  221
  Citations

• Spectroscopic Properties and Electronic Structure of Five- and Six-Coordinate Iron(II) Porphyrin NO Complexes: Effect of the Axial N-Donor Ligand

  V. K. K. Praneeth;Christian Näther;Gerhard Peters;Nicolai Lehnert

  189
  Citations

• Mono- and dinuclear non-heme iron–nitrosyl complexes: Models for key intermediates in bacterial nitric oxide reductases

  Timothy C. Berto;Amy L. Speelman;Sheng Zheng;Nicolai Lehnert

  181
  Citations

• Spectroscopic properties and electronic structure of low-spin Fe(III)-alkylperoxo complexes: homolytic cleavage of the O-O bond.

  Nicolai Lehnert;Raymond Y. N. Ho;Lawrence Que;Edward I. Solomon

  179
  Citations

• Electronic Structure and Biologically Relevant Reactivity of Low-Spin {FeNO}8 Porphyrin Model Complexes: New Insight from a Bis-Picket Fence Porphyrin

  Lauren E. Goodrich;Saikat Roy;E. Ercan Alp;Jiyong Zhao

  177
  Citations

• The radical mechanism of biological methane synthesis by methyl-coenzyme M reductase.

  Thanyaporn Wongnate;Dariusz Sliwa;Bojana Ginovska;Dayle Smith

  173
  Citations

• Hydrogen Sulfide Oxidation by Myoglobin

  Trever Bostelaar;Victor Vitvitsky;Jacques Kumutima;Brianne E. Lewis

  165
  Citations

• Binding and activation of nitrite and nitric oxide by copper nitrite reductase and corresponding model complexes

  Anna C. Merkle;Nicolai Lehnert

  165
  Citations

• Electronic Structure of High-Spin Iron(III)−Alkylperoxo Complexes and Its Relation to Low-Spin Analogues: Reaction Coordinate of O−O Bond Homolysis

  Nicolai Lehnert;Raymond Y. N. Ho;Lawrence Que;Edward I. Solomon

  161
  Citations

• Electronic structure of six-coordinate iron(III)-porphyrin NO adducts: the elusive iron(III)-NO(radical) state and its influence on the properties of these complexes.

  V. K. K. Praneeth;Florian Paulat;Timothy C. Berto;Serena DeBeer George

  160
  Citations

• Structural and Electronic Differences of Copper(I) Complexes with Tris(pyrazolyl)methane and Hydrotris(pyrazolyl)borate Ligands

  Kiyoshi Fujisawa;Tetsuya Ono;Yoko Ishikawa;Nagina Amir

  157
  Citations

• Density-functional investigation on the mechanism of H-atom abstraction by lipoxygenase

  Nicolai Lehnert;Edward I Solomon

  155
  Citations

• Electronic structure and reactivity of low-spin Fe(III)-hydroperoxo complexes: comparison to activated bleomycin.

  Nicolai Lehnert;Frank Neese;Raymond Y. N. Ho;Lawrence Que Jr.

  147
  Citations

• Grand challenges in the nitrogen cycle.

  Nicolai Lehnert;Bradley W. Musselman;Lance C. Seefeldt

  141
  Citations

• Catalytic Cyclopropanation by Myoglobin Reconstituted with Iron Porphycene: Acceleration of Catalysis due to Rapid Formation of the Carbene Species.

  Koji Oohora;Hiroyuki Meichin;Liming Zhao;Matthew W. Wolf

  135
  Citations

• Quantum chemistry-based analysis of the vibrational spectra of five-coordinate metalloporphyrins [M(TPP)Cl].

  Florian Paulat;V. K. K. Praneeth;Christian Näther;Nicolai Lehnert

  134
  Citations

• Direct Hydrogen-Atom Abstraction by Activated Bleomycin: An Experimental and Computational Study

  Andrea Decker;Marina S. Chow;Jyllian N. Kemsley;Nicolai Lehnert

  129
  Citations

• Electronic structure of iron(II)-porphyrin nitroxyl complexes: molecular mechanism of fungal nitric oxide reductase (P450nor).

  Nicolai Lehnert;V. K. K. Praneeth;Florian Paulat

  126
  Citations