2015

303. DFT Modeling of the Aldehyde-Water Shift Reaction with a Cationic Cp*Ir Catalyst, W. C. Ou, T. R. Cundari, ACS Catalysis, 2015, 5, 225-232. DOI: 10.1021/cs501222m

304. A comparison of the Simmons-Smith reaction with carbenoids to nitrenoids and oxenoids, S. K. Khani, T. R. Cundari, Comp. Theor. Chem., 2015, 1056, 61-73. DOI: 10.1016/j.comptc.2015.01.005

305. A Rhodium Catalyst for Single-Step Styrene Production, B. A. Vaughan, M. S. Webster-Gardiner, T. R. Cundari, T. B. Gunnoe, Science, 2015, 348, 421-424. DOI: 10.1126/science.aaa2260

306. Oxy Functionalization with Cp*IrIII(NHC)(Me)(Cl) with O2: Identification of a Rare Bimetallic IrIV μ-oxo Intermediate, M. C. Lehman, D. R. Pahls, J. M. Meredith, R. D. Sommer, D. M. Heinekey, T. R. Cundari, E. A. Ison, J. Am. Chem. Soc. , 2015, 127, 3574-3584. DOI: 10.1021/ja512905t

307. Reductive functionalization of 3d metal-methyl complexes: The greater importance of ligand than metal, H. Fallah, T. R. Cundari, Comp. Theor. Chem., 2015, 1069, 86-95. DOI: 10.1021/cs501222m

308. First-Row Transition Metal and Lithium Pyridine-ene-amide Complexes Exhibiting N- and C-Isomers and Ligand-based Activation of Benzylic C-H Bonds, B. M. Lindley, P. T. Wolczanski, T. R. Cundari, E. B. Lobkovsky, Organometallics, 2015, - Hillhouse Memorial Issue, in press. DOI: 10.1021/acs.organomet.5b00385

309. DFT Study of Reductive Functionalization in Cis and Trans Cobalt-Methyl-Bipyridine Complexes, S. L. Teaw, B. W. Thornton, F. Jia, J. Qian, D. R. Pahls, T. R. Cundari, Comp. Theor. Chem., 2015, 1073, 102-105. DOI: 10.1016/j.comptc.2015.09.021

310. Methane is the Best Substrate for (sp3)C-H activation with Cp*(PMe3)Co(Me)(OTf). A Density Functional Theory Study, S. M. Bellows, T. R. Cundari, W. D. Jones, Organometallics, 2015, 34, 4032-4038. DOI: 10.1021/acs.organomet.5b00452

311. Effect of Ligand Connectivity and Charge State on the Amination of C‒H Bonds by Copper Amide Complexes, O. Olatunji-Ojo, T. R. Cundari, Organometallics, 2015, 34,5045-5050. DOI: 10.1021/acs.organomet.5b00623

312. Nitrene Insertion into CC and CH Bonds of Diamide-diimine Ligated Chromium and Iron Complexes, S. P. Heins, W. D. Morris, P. T. Wolczanski, E. B. Lobkovsky, T. R. Cundari, Angew. Chem., Int. Ed. , 2015, 54, 14407-14411. DOI: 10.1002/anie.201507463

313. Zinc(II) Mediated Carbene Insertion into C-H Bonds in Alkanes, N. Kulkarni, C. Dash, N. Jayaratna, S. Ridlen, S. K. Khani, A. Das, X. Kou, M. Yousufuddin, T. R. Cundari, H. V. R. Dias, Inorg. Chem., 2015, 54, 11043-11045. DOI: 10.1021/acs.inorgchem.5b02134

314. Gold Mediated Isomerization of Cyclooctyne to Ring Fused Olefinic Bicycles, H. V. R. Dias, A. Das, T. R. Cundari, M. Yousufuddin, Eur. J. Inorg. Chem., 2015, 54,11043-11045 . DOI: 10.1002/ejic.201600021