Proton-coupled electron transfer DR Weinberg, CJ Gagliardi, JF Hull, CF Murphy, CA Kent, BC Westlake, ... Chemical Reviews 112 (7), 4016-4093, 2012 | 1599 | 2012 |
Distortion/interaction energy control of 1, 3-dipolar cycloaddition reactivity DH Ess, KN Houk Journal of the American Chemical Society 129 (35), 10646-10647, 2007 | 946 | 2007 |
Theory of 1, 3-dipolar cycloadditions: distortion/interaction and frontier molecular orbital models DH Ess, KN Houk Journal of the American Chemical Society 130 (31), 10187-10198, 2008 | 863 | 2008 |
Bifurcations on potential energy surfaces of organic reactions DH Ess, SE Wheeler, RG Iafe, L Xu, N Çelebi‐Ölçüm, KN Houk Angewandte Chemie International Edition 47 (40), 7592-7601, 2008 | 397 | 2008 |
Conceptual, qualitative, and quantitative theories of 1, 3‐dipolar and diels–alder cycloadditions used in synthesis DH Ess, GO Jones, KN Houk Advanced Synthesis & Catalysis 348 (16‐17), 2337-2361, 2006 | 326 | 2006 |
Direct stereospecific synthesis of unprotected NH and N-Me aziridines from olefins JL Jat, MP Paudyal, H Gao, QL Xu, M Yousufuddin, D Devarajan, DH Ess, ... Science 343 (6166), 61-65, 2014 | 303 | 2014 |
Activation energies of pericyclic reactions: performance of DFT, MP2, and CBS-QB3 methods for the prediction of activation barriers and reaction energetics of 1, 3-dipolar … DH Ess, KN Houk The journal of physical chemistry A 109 (42), 9542-9553, 2005 | 279 | 2005 |
Reactivity and regioselectivity in 1, 3-dipolar cycloadditions of azides to strained alkynes and alkenes: a computational study F Schoenebeck, DH Ess, GO Jones, KN Houk Journal of the American Chemical Society 131 (23), 8121-8133, 2009 | 260 | 2009 |
Transition states of strain-promoted metal-free click chemistry: 1, 3-dipolar cycloadditions of phenyl azide and cyclooctynes DH Ess, GO Jones, KN Houk Organic Letters 10 (8), 1633-1636, 2008 | 259 | 2008 |
Dirhodium-catalyzed CH arene amination using hydroxylamines MP Paudyal, AM Adebesin, SR Burt, DH Ess, Z Ma, L Kürti, JR Falck Science 353 (6304), 1144-1147, 2016 | 251 | 2016 |
Organocatalytic aryl–aryl bond formation: an atroposelective [3, 3]-rearrangement approach to BINAM derivatives GQ Li, H Gao, C Keene, M Devonas, DH Ess, L Kürti Journal of the American Chemical Society 135 (20), 7414-7417, 2013 | 242 | 2013 |
Precursor transformation during molecular oxidation catalysis with organometallic iridium complexes U Hintermair, SW Sheehan, AR Parent, DH Ess, DT Richens, PH Vaccaro, ... Journal of the American Chemical Society 135 (29), 10837-10851, 2013 | 225 | 2013 |
Rapid Synthesis of Fused N‐Heterocycles by Transition‐Metal‐Free Electrophilic Amination of Arene C H Bonds H Gao, QL Xu, M Yousufuddin, DH Ess, L Kürti Angewandte Chemie International Edition 53 (10), 2701-2705, 2014 | 206 | 2014 |
Design and optimization of catalysts based on mechanistic insights derived from quantum chemical reaction modeling S Ahn, M Hong, M Sundararajan, DH Ess, MH Baik Chemical reviews 119 (11), 6509-6560, 2019 | 178 | 2019 |
Main-group compounds selectively oxidize mixtures of methane, ethane, and propane to alcohol esters BG Hashiguchi, MM Konnick, SM Bischof, SJ Gustafson, D Devarajan, ... Science 343 (6176), 1232-1237, 2014 | 167 | 2014 |
Intermolecular N–H Oxidative Addition of Ammonia, Alkylamines, and Arylamines to a Planar σ3-Phosphorus Compound via an Entropy-Controlled Electrophilic … SM McCarthy, YC Lin, D Devarajan, JW Chang, HP Yennawar, RM Rioux, ... Journal of the American Chemical Society 136 (12), 4640-4650, 2014 | 157 | 2014 |
Elusive metal-free primary amination of arylboronic acids: synthetic studies and mechanism by density functional theory C Zhu, G Li, DH Ess, JR Falck, L Kürti Journal of the American Chemical Society 134 (44), 18253-18256, 2012 | 153 | 2012 |
Electrophilic, ambiphilic, and nucleophilic C− H bond activation: Understanding the electronic continuum of C− H bond activation through transition-state and reaction pathway … DH Ess, WA Goddard III, RA Periana Organometallics 29 (23), 6459-6472, 2010 | 137 | 2010 |
Singlet− triplet energy gaps for diradicals from fractional-spin density-functional theory DH Ess, ER Johnson, X Hu, W Yang The Journal of Physical Chemistry A 115 (1), 76-83, 2011 | 130 | 2011 |
Practical Organocatalytic Synthesis of Functionalized Non‐C2‐Symmetrical Atropisomeric Biaryls H Gao, QL Xu, C Keene, M Yousufuddin, DH Ess, L Kürti Angewandte Chemie 128 (2), 576-581, 2016 | 114 | 2016 |