Search Results - "O’Hagan, Molly J."

Synthesis, Characterization, and Reactivity of Fe Complexes Containing Cyclic Diazadiphosphine Ligands: The Role of the Pendant Base in Heterolytic Cleavage of H2 by Liu, Tianbiao, Chen, Shentan, O’Hagan, Molly J, Rakowski DuBois, Mary, Bullock, R. Morris, DuBois, Daniel L

“…The iron complexes CpFe­(PPh 2NBn 2)Cl (1-Cl), CpFe­(PPh 2NPh 2)Cl (2-Cl), and CpFe­(PPh 2C5)Cl (3-Cl) (where PPh 2NBn 2 is…”
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Synthesis and Hydride Transfer Reactions of Cobalt and Nickel Hydride Complexes to BX3 Compounds by Mock, Michael T, Potter, Robert G, O’Hagan, Molly J, Camaioni, Donald M, Dougherty, William G, Kassel, W. Scott, DuBois, Daniel L

“…Hydrides of numerous transition metal complexes can be generated by the heterolytic cleavage of H2 gas such that they offer alternatives to using main group…”
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A rare terminal dinitrogen complex of chromium by Mock, Michael T, Chen, Shentan, Rousseau, Roger, O'Hagan, Molly J, Dougherty, William G, Kassel, W Scott, DuBois, Daniel L, Bullock, R Morris

“…Cis and trans-Cr-N(2) complexes supported by the diphosphine ligand P(Ph)(2)N(Bn)(2) have been prepared. Positioned pendant amines in the second coordination…”
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Autoignition and select properties of low sample volume thermochemical mixtures from renewable sources by Olarte, Mariefel V., Albrecht, Karl O., Bays, J. Timothy, Polikarpov, Evgueni, Maddi, Balakrishna, Linehan, John C., O'Hagan, Molly J., Gaspar, Daniel J.

“…[Display omitted] •Measured autoignition propensity of biomass-derived thermochemical mixtures.•Confirmed feedstock and processing uniquely influence…”
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Binuclear Complexes Containing a Methylnickel Moiety: Relevance to Organonickel Intermediates in Acetyl Coenzyme A Synthase Catalysis by Dougherty, William G, Rangan, Krishnan, O’Hagan, Molly J, Yap, Glenn P. A, Riordan, Charles G

“…A series of binuclear NiNi complexes supported by a single thiolate bridge and containing a methylnickel moiety have been prepared and fully characterized. The…”
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Synthesis, Characterization, and Reactivity of Fe Complexes Containing Cyclic Diazadiphosphine Ligands: The Role of the Pendant Base in Heterolytic Cleavage of H 2 by Liu, Tianbiao, Chen, Shentan, O’Hagan, Molly J., Rakowski DuBois, Mary, Bullock, R. Morris, DuBois, Daniel L.

“…The iron complexes CpFe(PPh2NBn2)Cl (1-Cl), CpFe(PPh2NPh2)Cl (2-Cl), CpFe(PPh2C5)Cl (3-Cl) (where PPh2NBn2 is…”
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Moving Protons with Pendant Amines: Proton Mobility in a Nickel Catalyst for Oxidation of Hydrogen by O’Hagan, Molly, Shaw, Wendy J, Raugei, Simone, Chen, Shentan, Yang, Jenny Y, Kilgore, Uriah J, DuBois, Daniel L, Bullock, R. Morris

“…Proton transport is ubiquitous in chemical and biological processes, including the reduction of dioxygen to water, the reduction of CO2 to formate, and the…”
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Experimental and Computational Mechanistic Studies Guiding the Rational Design of Molecular Electrocatalysts for Production and Oxidation of Hydrogen by Raugei, Simone, Helm, Monte L, Hammes-Schiffer, Sharon, Appel, Aaron M, O’Hagan, Molly, Wiedner, Eric S, Bullock, R. Morris

“…Understanding how to control the movement of protons and electrons is crucial to the design of fast, efficient electrocatalysts for H2 production and oxidation…”
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Achieving Reversible H2/H+ Interconversion at Room Temperature with Enzyme-Inspired Molecular Complexes: A Mechanistic Study by Priyadarshani, Nilusha, Dutta, Arnab, Ginovska, Bojana, Buchko, Garry W, O’Hagan, Molly, Raugei, Simone, Shaw, Wendy J

“…Inspired by the contribution of the protein scaffold to the efficiency with which enzymes function, we used outer coordination sphere features to develop a…”
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Dinitrogen Reduction by a Chromium(0) Complex Supported by a 16-Membered Phosphorus Macrocycle by Mock, Michael T, Chen, Shentan, O’Hagan, Molly, Rousseau, Roger, Dougherty, William G, Kassel, W. Scott, Bullock, R. Morris

“…We report a rare example of a Cr–N2 complex supported by a 16-membered phosphorus macrocycle containing pendant amine bases. Reactivity with acid afforded…”
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Autoignition and select properties of low sample volume thermochemical mixtures from renewable sources by Olarte, Mariefel V., Albrecht, Karl O., Bays, J. Timothy, Polikarpov, Evgueni, Maddi, Balakrishna, Linehan, John C., O'Hagan, Molly J., Gaspar, Daniel J.

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Combined Spectroscopic and Electrochemical Detection of a NiI⋅⋅⋅HN Bonding Interaction with Relevance to Electrocatalytic H2 Production by Kochem, Amélie, O'Hagan, Molly, Wiedner, Eric S., van Gastel, Maurice

“…The [Ni(PR2NR′2)2]2+ family of complexes are exceptionally active catalysts for proton reduction to H2. In this manuscript, we explore the first protonation…”
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Iron Complexes Bearing Diphosphine Ligands with Positioned Pendant Amines as Electrocatalysts for the Oxidation of H2 by Liu, Tianbiao L., Liao, Qian, O'Hagan, Molly J., Hulley, Elliott, DuBois, Daniel L., Bullock, R. Morris

“…The synthesis and spectroscopic characterization of CpC5F4NFe(PtBu2NBn2)Cl, [3-Cl] (where C5F4N is the tetrafluorpyridyl substituent and PtBu2NBn2 =…”
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Conformational Dynamics and Proton Relay Positioning in Nickel Catalysts for Hydrogen Production and Oxidation by Franz, James A, O’Hagan, Molly, Ho, Ming-Hsun, Liu, Tianbiao, Helm, Monte L, Lense, Sheri, DuBois, Daniel L, Shaw, Wendy J, Appel, Aaron M, Raugei, Simone, Bullock, R. Morris

“…The [Ni(PR 2NR′ 2)2]2+ complexes (where PR 2NR′ 2 is 1,5-R′-3,7-R-1,5-diaza-3,7-diphosphacyclooctane) are fast electrocatalysts for H2 production and…”
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Methodology for the Development of Empirical Models Relating 13C NMR Spectral Features to Fuel Properties by Heredia-Langner, Alejandro, Cort, John R, Grubel, Katarzyna, O’Hagan, Molly J, Jarman, Kristin H, Linehan, John C, Albrecht, Karl O, Polikarpov, Evgueni, King, David L, Smurthwaite, Tricia D, Bays, J. Timothy

“…Effective formulation of new gasoline or diesel fuels for internal combustion engines would benefit from the development of reliable models for predicting key…”
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Active Hydrogenation Catalyst with a Structured, Peptide-Based Outer-Coordination Sphere by Jain, Avijita, Buchko, Garry W, Reback, Matthew L, O’Hagan, Molly, Ginovska-Pangovska, Bojana, Linehan, John C, Shaw, Wendy J

“…The synthesis, catalytic activity, and structural features of a rhodium-based hydrogenation catalyst containing a phosphine ligand coupled to a 14-residue…”
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Acidic Ionic Liquid/Water Solution as Both Medium and Proton Source for Electrocatalytic H2 Evolution by [Ni(P2N2)2]2+ Complexes by Pool, Douglas H., Stewart, Michael P., O'Hagan, Molly J., Shaw, Wendy J., Roberts, John A., Bullock, R. Morris, DuBois, Daniel L.

“…The electrocatalytic reduction of protons to H2 by [Ni(PPh2NC6H4-hex2)2](BF4)2 (where PPh2NC6H4-hex2 =…”
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Methodology for the Development of Empirical Models Relating 13 C NMR Spectral Features to Fuel Properties by Heredia-Langner, Alejandro, Cort, John R., Grubel, Katarzyna, O’Hagan, Molly J., Jarman, Kristin H., Linehan, John C., Albrecht, Karl O., Polikarpov, Evgueni, King, David L., Smurthwaite, Tricia D., Bays, J. Timothy

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Synthesis and reactivity of synthetic analogs for nickel redox enzymes: Superoxide dismutase and acetyl coenzyme A synthase by O'Hagan, Molly J

“…Synthetic model complexes of nickel-containing enzyme active sites are important tools for understanding the structure-function properties of the active sites…”
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Synthesis, Characterization, and Reactivity of Fe Complexes Containing Cyclic Diazadiphosphine Ligands: The Role of the Pendant Base in Heterolytic Cleavage of H 2 by Liu, Tianbiao, Chen, Shentan, O’Hagan, Molly J., Rakowski DuBois, Mary, Bullock, R. Morris, DuBois, Daniel L.

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