Publications
| Title | Citation | DOI |
|---|---|---|
| Predicting Emission Wavelengths in Benzobisoxazole-Based OLEDs with Gradient Boosted Ensemble Models | S. Tannir, Y. Pan, N. Josephs, C. Cunningham, N. R Hendrick, A. Beckett, J. McNeely, A. Beeler, M. Jeffries-El*, E. D. Kolaczyk*, J. Phys. Chem. A 2024, 6116–6123 | 10.1021/acs.jpca.4c00077 |
| Homoleptic Rare-Earth-Metal Sandwiches with Dibenzo[a,e]cyclooctatetraene Dianions | Y. Zhu, J. Mahoney, A. J. Babson, Z. Zhou, Z. Wei, M. Gakiya-Teruya, J. McNeely, A. Yu. Rogachev*, M. Shatruk*, and M. A. Petrukhina*, Inorg. Chem. 2024, 9579–9587 | 10.1021/acs.inorgchem.3c04249 |
| Chemoselective Aerobic Oxidation of Alcohols Utilizing a Vanadium(V) Catalyst | M. I. Kitt, E. Amir, E. R. Sloane, D. G. Fraser, J. E. Cerritelli, C. S. M. Sabanos, J. H. McNeely, J. K. Snyder, L. H. Doerrer*, and A. B. Beeler*, ACS Catal. 2024, 4799–4806 | 10.1021/acscatal.3c05638 |
| Asymmetric Synthesis of Nidulalin A and Nidulaxanthone A: Selective Carbonyl Desaturation Using an Oxoammonium Salt | K. Ji, R. P. Johnson, J. McNeely, M. A. Faruk, and J. A. Porco Jr.*, J. Am. Chem. Soc. 2024, 4892–4902 | 10.1021/jacs.3c13864 |
| Synthesis of Neocannabinoids Using Controlled Friedel–Crafts Reactions | A. M. Millimaci, R. V. Trilles, J. H. McNeely, L. E. Brown, A. B. Beeler*, and J. A. Porco Jr., J. Org. Chem. 2023, 13135–13141 | 10.1021/acs.joc.3c01362 |
| Organo-Functionalized Lacunary Double Cubane Type Oxometallates: Synthesis, Structure, and Properties of [(MIICl)2(VIVO)2{((HOCH2CH2)(H)N(CH2CH2O))(HN(CH2CH2O)2)}2] (M = Co, Zn) | D. T. Shuaib, L. Swenson, J. A. Kaduk, T. Chang, Y. Chen, J. McNeely, M. I. Khan, Chem. Eur. J. 2023, e202301389 | 10.1002/chem.202301389 |
| Extra-long C-C single bonds via negative hyperconjugation in perfluoropinacolate complexes | P. A. Homuth, J. McNeely, L. H. Doerrer, Polyhedron 2022, 116040 | j.poly.2022.116040 |
| Lanthanide-mediated tuning of electronic and magnetic properties in heterotrimetallic cyclooctatetraenyl multidecker self-assemblies | Z. Zhou, J. McNeely, J. Greenough, Z. Wei, H. Han, M. Rouzières, A. Yu Rogachev, R. Clérac, M. A. Petrukhina, Chem. Sci. 2022, 3864-3874 | 10.1039/D2SC00631F |
| Thiolate-Thione Redox-Active Ligand with a Six-Membered Chelate Ring via Template Condensation and Its Pt(II) Complexes | L. A. Zuckerman, N. P. Vargo, C. V. May, M. P. Crockett, A. S. Hyre, J. McNeely, J. K. Elinburg, A. M. Brown, J. R. Robinson, A. L. Rheingold, L. H. Doerrer, Inorg. Chem. 2021, 13376–13387 | 10.1021/acs.inorgchem.1c01693 |
| Interfacial hydration determines orientational and functional dimorphism of sterol-derived Raman tags in lipid-coated nanoparticles | X. An, A. Mujumder, J. McNeely, J. Yang, T. Puri, Z. He, T. Liang, J. K. Snyder, J. E. Straub, B. M. Reinhard PNAS 2021 | 10.1073/pnas.2105913118 |
| Role of Fe Doping on Local Structure and Electrical and Magnetic Properties of PbTiO3 | H. Ganegoda, S. Mukherjee, B. Ma, D. T. Olive, J. H. McNeely, J. A. Kaduk, J. Terry, H. Rensmo, and C. U. Segre J. Phys. Chem. C 2021, 12342-12354. | 10.1021/acs.jpcc.1c02297 |
| Chemical enhancement effects on protoporphyrin IX surface‐enhanced Raman spectra: Metal substrate dependence and a vibronic theory analysis | J. McNeely, H. M. Ingraham, W. R. Premasiri, L. D. Ziegler J. Raman Spectrosc. 2020, 1-16. | 10.1002/jrs.6009 |
| New benzene dimers: a benchmark theoretical investigation | J. McNeely, A. Yu Rogachev Theor. Chem. Acc. 2020, 139, 168. | 10.1007/s00214-020-02684-y |
| Formation of monomeric Sn(ii) and Sn(iv) perfluoropinacolate complexes and their characterization by 119Sn Mössbauer and 119Sn NMR spectroscopies | J. K. Elinburg, A. S. Hyre, J. McNeely, T. M. Alam, S. Klenner, R. Pöttgen, A. L. Rheingold, L. H. Doerrer Dalton Trans. 2020, 49, 13773. | 10.1039/D0DT02837A |
| Guidelines for β-Lactam Synthesis: Glycal Protecting Groups Dictate Stereoelectronics and [2+2] Cycloaddition Kinetics | A. S. Balijepalli, J. H. McNeely, A. Hamoud, M. W. Grinstaff J. Org. Chem. 2020, 85, 12044. | 10.1021/acs.joc.0c005102 |
| Luminescence of Lanthanide Complexes with Perfluorinated Alkoxide Ligands | C. M. Kotyk, J. E. Weber, A. S. Hyre, J. McNeely, J. H. S. K. Monteiro, M. Domin, G. J. Balaich, A. L. Rheingold, A. de Bettencourt-Dias, L. H. Doerrer Inorg. Chem. 2020, 59, 9807. | 10.1021/acs.inorgchem.0c00782 |
| Angstrom-Scale Ruler Using Single Molecule Conductance Signatures | J. McNeely, N. Miller, X. Pan, B. Lawson, M. Kamenetska J. Phys. Chem. C 2020, 124, 13427. | 10.1021/acs.jpcc.0c02063 |
| New benzene dimers: an MRMP2 study. | J. McNeely, A. Yu Rogachev Theor. Chem. Acc. 2020, 139, 87. | 10.1007/s00214-020-02598-9 |
| Theoretical investigation of the record 7Li-NMR chemical shift in new sandwich-like aggregates of corannulene | J. McNeely, A. Yu Rogachev Theor. Chem. Acc. 2020, 139, 35. | 10.1007/s00214-020-2549-4 |
| Gold(I)-Mediated Cycloisomerization/Cycloaddition Enables Bioinspired Syntheses of Neonectrolides B–E and Analogues | T. J. Purgett, M. W. Dyer, B. Bickel, J. McNeely, J. A. Porco Jr. J. Am. Chem. Soc. 2019, 141, 15135-15144. | 10.1021/jacs.9b06355 |
| Isolation and Synthesis of Novel Meroterpenoids from Rhodomyrtus tomentosa: Investigation of a Reactive Enetrione Intermediate | X. Qin, T. J. Rauwolf, P. Li, H. Liu, J. McNeely, Y. Hua, H. Liu and J. A. Porco, Angew. Chem. Int. Ed. 2019, 58, 1-7. | 10.1002/anie.201814421 |
| Square-planar Co(III) in {O4} coordination: large ZFS and reactivity with ROS | J. L. Steele, L. Tahsini, C. Sun, J. K. Elinburg, C. M. Kotyk, J. McNeely, S. A. Stoian, A. Dragulescu-Andrasi, A. Ozarowski, M. Ozerov, J. Krzystek, J. Telser, J. W. Bacon, J. A. Golen, A. L. Rheingold and L. H. Doerrer, Chem. Comm. 2018, 54, 12045-12048. | 10.1039/C8CC04464C |
| Total Synthesis of Aurofusarin: Studies on the Atropisomeric Stability of Bis-Naphthoquinones | C. Qi, W. Wang, K. D. Reichl, J. McNeely and J. A. Porco, Jr., Angew. Chem. Int. Ed. 2018, 57, 2101. | 10.1002/anie.201711535 |
| Quasi-1D chains of dinickel lantern complexes and their magnetic properties | A. Nimthong-Roldàn, J. L. Guillet, J. McNeely, T. J. Ozumerzifon, M. P. Shores, J. A. Golen, A. L. Rheingold and L. H. Doerrer, Dalton Trans. 2017, 46, 5546. | 10.1039/C6DT04535A |
| LCu(μ-X)CuL compounds: An induced cuprophilic interaction | P. E. Chen, J. McNeely, J. S. Lum, E. J. Gardner, V. Phillips, J. A. Golen, A. L. Rheingold and L. H. Doerrer, Polyhedron 2016, 116, 204. | 10.1016/j.poly.2016.05.033 |
| Self-assembly of tetrareduced corannulene with mixed Li–Rb clusters: dynamic transformations, unique structures and record 7Li NMR shifts | A. S. Filatov, S. N. Spisak, A. V. Zabula, J. McNeely, A. Yu. Rogachev and M. A. Petrukhina, Chem. Sci. 2015, 6, 1959. | 10.1039/C4SC03485F |
| A Mixed-Valence Vanadate as Model for the Vanadium Mineral Melanovanadite: Hydrothermal Synthesis, Crystal Structure, and Magnetic Properties of MgV(V)2V(IV)16 • 4H2O | M. I. Khan, K. Aydemir, J. H. McNeely, B. Cage and R. J. Doedens, Cryst. Growth Des., 2012, 12, 3656. | 10.1021/cg3004678 |
| DFT-BS examination of exchange coupling in chromium(III) dimers containing the μ1,2-squarato bridge | J. McNeely and B. Cage, Inorganica Chim. Acta 2012, 384, 189-196. | 10.1016/j.ica.2011.11.064 |
| Hybrid materials composed of tetravanadate motifs: Synthesis, structure and magnetic properties of the open framework structure solids [{M(C5H5N)4}2]V4O12 (M = Cu, Co) | M. I. Khan, R. C. Nome, N. R. Putrevu, J. H. McNeely, B. Cage and R. J. Doedens, Inorganica Chim. Acta 2010, 363, 4307-4312 . |
10.1016/j.ica.2010.07.023 |
| Inorganic-Organic Hybrid Materials with Novel Framework Structures: Synthesis, Structures, and Magnetic Properties of [Ni(py)4]V10O29 and [Ni(py)6(H2O)3]V4O12 | M. I. Khan, R. C. Nome, S. Deb, J. H. McNeely, B. Cage and R. J. Doedens, Cryst. Growth Des. 2009, 9, 2848 . |
10.1021/cg9001237 |
| Thermomagnetic properties of the Finland trityl radical | B. Cage, J. H. McNeely, S. E. Russek and H. J. Halpern, J. Appl. Phys. 2009, 105, 043905. | 10.1063/1.3073992 |