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Desiree Bates
Desiree Bates
Computational Chemsitry Leader, University of Wisconsin-Madison
Dirección de correo verificada de chem.wisc.edu - Página principal
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Enantioselective photochemistry through Lewis acid–catalyzed triplet energy transfer
TR Blum, ZD Miller, DM Bates, IA Guzei, TP Yoon
Science 354 (6318), 1391-1395, 2016
3412016
CCSD (T) complete basis set limit relative energies for low-lying water hexamer structures
DM Bates, GS Tschumper
The Journal of Physical Chemistry A 113 (15), 3555-3559, 2009
2362009
Spin‐Selective Generation of Triplet Nitrenes: Olefin Aziridination through Visible‐Light Photosensitization of Azidoformates
SO Scholz, EP Farney, S Kim, DM Bates, TP Yoon
Angewandte Chemie International Edition 55 (6), 2239-2242, 2016
1252016
Development of a 3-body: many-body integrated fragmentation method for weakly bound clusters and application to water clusters (H2O) n= 3− 10, 16, 17
DM Bates, JR Smith, T Janowski, GS Tschumper
The Journal of chemical physics 135 (4), 2011
802011
Single-molecule investigation of initiation dynamics of an organometallic catalyst
JD Ng, SP Upadhyay, AN Marquard, KM Lupo, DA Hinton, NA Padilla, ...
Journal of the American Chemical Society 138 (11), 3876-3883, 2016
742016
Efficient and accurate methods for the geometry optimization of water clusters: Application of analytic gradients for the two-body: many-body QM: QM fragmentation method to …
DM Bates, JR Smith, GS Tschumper
Journal of chemical theory and computation 7 (9), 2753-2760, 2011
672011
Electrochemical strategy for hydrazine synthesis: development and overpotential analysis of methods for oxidative N–N coupling of an ammonia surrogate
F Wang, JB Gerken, DM Bates, YJ Kim, SS Stahl
Journal of the American Chemical Society 142 (28), 12349-12356, 2020
592020
Mechanistic Studies of Copper (I)-Catalyzed 1, 3-Halogen Migration
R Van Hoveln, BM Hudson, HB Wedler, DM Bates, G Le Gros, DJ Tantillo, ...
Journal of the American Chemical Society 137 (16), 5346-5354, 2015
512015
Probing the effects of heterogeneity on delocalized π⋯ π interaction energies
DM Bates, JA Anderson, P Oloyede, GS Tschumper
Physical Chemistry Chemical Physics 10 (19), 2775-2779, 2008
342008
The 103–360 GHz rotational spectrum of benzonitrile, the first interstellar benzene derivative detected by radioastronomy
MA Zdanovskaia, BJ Esselman, HS Lau, DM Bates, RC Woods, ...
Journal of Molecular Spectroscopy 351, 39-48, 2018
332018
Practical and General Alcohol Deoxygenation Protocol
OP Williams, AF Chmiel, M Mikhael, DM Bates, CS Yeung, ZK Wickens
Angewandte Chemie 135 (18), e202300178, 2023
232023
Fluorescent dendrimeric molecular catalysts demonstrate unusual scaling behavior at the single-molecule level
SP Upadhyay, KM Lupo, AN Marquard, JD Ng, DM Bates, RH Goldsmith
The Journal of Physical Chemistry C 119 (34), 19703-19714, 2015
192015
Intermolecular [2+ 2] photocycloaddition of β-Nitrostyrenes to olefins upon irradiation with visible light
LM Mohr, T Bach
Synlett 28 (20), 2946-2950, 2017
152017
Polar Heterobenzylic C(sp3)–H Chlorination Pathway Enabling Efficient Diversification of Aromatic Nitrogen Heterocycles
S Maity, MA Lopez, DM Bates, S Lin, SW Krska, SS Stahl
Journal of the American Chemical Society 145 (36), 19832-19839, 2023
102023
Improving Climate and Outcomes for Underrepresented Chemistry Graduate Students at a Major Research University: A Case Study
RJ Hamers, DM Bates, KJ Aguayo Barragan, DG Gressel, BS Schweitzer, ...
Journal of Chemical Education 99 (1), 452-460, 2021
52021
Enantioselective Photochemistry through Lewis Acid Catalyzed Triplet Energy Transfer
T Blum, I Guzei, Z Miller, T Yoon, D Bates
SYNTHESIS-STUTTGART 49 (5), A44-A47, 2017
2017
Fluorescent Dendrimeric Molecular Catalysts Demonstrate Unusual Scaling Behavior at the Single-Molecule Level (vol 119, pg 19703, 2015)
SP Upadhyay, KM Lupo, AN Marquard, JD Ng, DM Bates, RH Goldsmith
Journal of Physical Chemistry C 119 (44), 25134-25134, 2015
2015
Computational mechanistic investigation of a Cu (I)-catalyzed 1, 3-halogen migration
B Hudson, H Wedler, R Van Hoveln, D Bates, D Tantillo, J Schomaker
ABSTRACTS OF PAPERS OF THE AMERICAN CHEMICAL SOCIETY 249, 2015
2015
Theoretical Characterization of Non-Covalent Weakly Bound Clusters Through the Application of Sophisticated Computational Quantum Chemistry Methodologies and the Development of …
D Bates
2011
Attempted synthesis of polyphosphonium salts
TW Nalli, D Bates, C Skar, S Mahabamunuge
ABSTRACTS OF PAPERS OF THE AMERICAN CHEMICAL SOCIETY 237, 2009
2009
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