251. Single-Electron Oxidation of N-Heterocyclic Carbene-Supported Nickel Amides Yielding Benzylic C-H Activation, C. A. Laskowski, G. R. Morello, C. T. Saouma, T. R. Cundari, G. L. Hillhouse, Chem. Sci. (Edge Article), 2013, 4 170-174. DOI: 10.1039/C2SC21345A
252. Variable Pathways for Oxygen Atom Insertion into Metal-Carbon Bonds: The Case of Cp*W(O)2(CH2SiMe3), J. J. Mei, K. M. Carsch, C. R. Freitag, T. B. Gunnoe, T. R. Cundari J. Am. Chem. Soc, 2013, 135 424-435. DOI: 10.1021/ja309755g
253. Metal Mediated Oxo Insertion into Platinum-Carbon Bonds: A Computational Hammett Analysis,T. M. Figg, T. R. Cundari Dalton Trans, 2013, 42 4114 - 4121. DOI: 10.1039/C2DT31983G
254. Mechanism of Hydrogenolysis of an Iridium-Methyl Bond: Evidence for a Methane Complex Intermediate, J. Campos, E. Carmona, M. Brookhart, S. Kundu, D. R. Pahls, T. R. Cundari J. Am. Chem. Soc, 2013, 135 1217-1220. DOI: 10.1021/ja310982v
255. Periodic Trends in Metal Mediated CO2 Activation, C. Liu, T. R. Cundari, A. K. Wilson Applications of Molecular Modeling to Challenges in Clean Energy American Chemical Society Symposium Series, G. Fitzgerald, N. Govind (Eds.), ACS: Washington, D. C., 2013, Chapter 5, pp. 67 - 88 DOI: 10.1021/bk-2013-1133.ch005
256. Complete Methane-to-Methanol Catalytic Cycle: A DFT Study of Oxygen Atom Transfer from N2O to late-row (M = Ni, Cu, Zn) β-diketiminate C-H Activation Catalysts, C. M. McMullin, A. W. Pierpont, T. R. Cundari Polyhedron (100th Anniversry of the Award of the 1913 Nobel Prize in Chemistry to Alfred Werner special issue, Invited), 2013, 52 945-956. DOI: 10.1016/j.bbr.2011.03.031
257. Selective Extraction of N2 from Air by Diarylimine Iron Complexes, E. R. Bartholomew, E. C. Volpe, P. T. Wolczanski, E. B. Lobkovsky, T. R. Cundari J. Am. Chem. Soc., 2013, 135 3295 - 3312. DOI: 10.1021/ja311021u
258. C-C Bond Formation and Related Reactions at the CNC Backbone in (smif)FeX (smif = 1,3-di-(2-pyridyl)-2-azaallyl): Dimerizations, 3+2 Cyclization, and Nucleophilic Attack; Hydrogenations and Alkyne Trimerization (X = N(TMS)2, dpma (di-(2-pyridyl-methyl)-amide)), B. A. Frazier, P. T. Wolczanski, S. C. Bart, K. Meyer, T. R. Cundari, E. B. Lobkovsky Inorg. Chem., 2013, 52 3511 - 3527. DOI: 10.1021/ic302783y
259. Facile and Regioselective C-H Bond Activation of Aromatic Substrates by an Fe(II) Complex Involving a Spin-Forbidden Pathway, S. E. Kalman, A. Petit, T. B. Gunnoe, D. H. Ess, T. R. Cundari, M. Sabat Organometallics, 2013, 321797 - 1806. DOI: 10.1021/om301219t
260. Pt(II) Catalyzed Ethylene Hydrophenylation: Switching Selectivity between Alkyl and Vinyl Benzene Production, B. A. McKeown, H. E. Gonzalez, M. R. Friedfeld, A. M. Brosnahan, T. B. Gunnoe, T. R. Cundari, M. Sabat Organometallics, 2013, 32 2857-2865. DOI: 10.1021/om400306w
261. Use of [SbF6]- to Isolate Cationic Copper and Silver Adducts with More than one Ethylene on the Metal Center, Mauro Fianchini, Charles F. Campana, Thomas R. Cundari, and H. V. Rasika Dias Organometallics, 2013, 32 3034-3041. DOI: 10.1021/om4002439
262. PtII Catalyzed Ethylene Hydrophenylation: Influence of Dipyridyl Chelate Ring Size on Catalyst Activity and Longevity, B. A. McKeown, H. E. Gonzalez, T. B. Gunnoe, T. R. Cundari, M. Sabat ACS Catalysis, 2013, 3 1165 - 1171. DOI: 10.1021/cs400231f
263. Electronic and Charge-Transport Properties of the Au3(CH3N═COCH3)3 Crystal: A Density Functional Theory Study, Lingyun Zhu, Veaceslav Coropceanu, Yuanping Yi, Bhaskar Chilukuri, Thomas R. Cundari, and Jean-Luc Brédas J. Phys. Chem. Lett., 2013, 42 2186-2189. DOI: 10.1021/jz400950v
264. C-H Activation by Multiply Bonded Complexes with Potentially Non-Innocent Ligands: A Computational Study, O. A. Olatunji-Ojo, T. R. Cundari; Inorg. Chem, 2013, 52 (14), 8106-8113. DOI: 10.1080/14786435.2013.827801
265. Cooperative Carbon Capture Capabilities in Multivariate MOFs Decorated with Amino Acid Side Chains: A Computational Study, M. L. Drummond, T. R. Cundari, A. K. Wilson J. Phys. Chem. C, 2013, 117 14717-14722. DOI: 10.1021/jp4053538
266. Computational Study of Carbon-Hydrogen Bond Deprotonation by Alkali Metal Superbases, Pardue, D. B., Gustafson, S. J., Periana, R. A., Ess, D. H., Cundari, T. R. Comp. Theor. Chem. , 2013, 1019, 85-93. DOI: 10.1016/j.comptc.2013.06.041
267. Computational Hammett Analysis of Redox Based Oxy-Insertion by Pt(II) Complexes, T. M. Figg, T. R. Cundari, Dalton Trans. (Crabtree Special Issue) (Invited), 2012, 42 4114-4121. DOI: 10.1039/C2DT31983G
268. Lewis Bases Trigger Intramolecular CH-Bond Activation: (silox)2W=NtBu <=> (silox)((η2-O,C-OSitBu2CMe2CH2)HW=NtBu (silox = OSitBu3), M. Marshak, D. C. Rosenfeld, W.D. Morris, P. T. Wolczanski, E. B. Lobkovsky, T. R. Cundari Eur. J. Inorg. Chem. (Invited), 2013, 22-23 4056 - 4067. DOI: 10.1002/ejic.201300234
269. Pt(II) and Rh(III) Hydrocarbyl Complexes Bearing Coordinated Oxygen Atom Delivery Reagents, J. R. Webb, T. M. Figg, B. M. Otten, T. B. Gunnoe, T. R. Cundari, M. Sabat Eur. J. Inorg. Chem, 2013, 25 4515-4525. DOI: 10.1002/ejic.201300434
270. Spin Crossover during β-hydride Elimination in High-spin Iron(II) and Cobalt(II) Alkyl Complexes;, S. M. Bellows, T. R. Cundari, P. L. Holland, Organometallics, 2013, 32 4741-4851. DOI: 10.1021/om400325x
271. Structure and Bonding of Palladium Oxos as Possible Intermediates in Metal-Carbon Oxy Insertion Reactions, T. M. Figg, G. Schoendorff, B. Chiulukuri, T. R. Cundari, Organometallics, 2013, 32 4993-4996. DOI: 10.1021/om400290r
272. Chemical Bonds Involving d-Orbitals, T. R. Cundari, Chem. Commun. (invited) , 2013, 49 9521-9525. DOI: 10.1039/c3cc45204b
273. Methane C--H Bond Activation by "Naked" Alkali Metal Imidyl and Alkaline Earth Metal Imide Complexes. The Role of Ligand Spin and Nucleophilicity, B. M. Prince, T. R. Cundari, J. Phys. Chem. A , 2013, 49 9245 - 9251. DOI: 10.1021/jp404951e
274. Silver(I) Complexes of Tris(pyrazolyl)borate Ligands Bearing Six Trifluoromethyl and Three Additional Electron-Withdrawing Substituents, N. B. Jayaratna, D. B. Pardue, M. Yousufuddin, K. G. Thakur, T. R. Cundari, H. V. R. Dias J. Chem. Soc., Dalton, 2013, 42, 15399-15410. DOI: 10.1039/c3dt52152d
275. Gold mediated expulsion of dinitrogen from organic azides, C. Dash, M. Yousufuddin, T. R. Cundari, H. V. R. Dias J. Am. Chem. Soc. , 2013, 135 15479 - 15488. DOI: 10.1021/ja406027x
276. Activation of Carbon-Hydrogen Bonds by 1,2-CH-addition Across Metal-Heteroatom Bonds, J. R. Webb, S. A. Burgess, T. R. Cundari, T. B. Gunnoe, Dalton Trans. (Perspective) (Invited) , 2013, 42 16646 - 16665. DOI: 10.1039/C3DT52164H