Year |
Citation |
Score |
2024 |
Sun W, Pinacho P, Obenchain DA, Schnell M. Gas-Phase Characterization of Adipic Acid, 6-Hydroxycaproic Acid, and Their Thermal Decomposition Products by Rotational Spectroscopy. The Journal of Physical Chemistry Letters. 817-825. PMID 38232320 DOI: 10.1021/acs.jpclett.3c02969 |
0.637 |
|
2023 |
Loru D, Steber AL, Pérez C, Obenchain DA, Temelso B, López JC, Schnell M. Quantum Tunneling Facilitates Water Motion across the Surface of Phenanthrene. Journal of the American Chemical Society. PMID 37494139 DOI: 10.1021/jacs.3c04281 |
0.793 |
|
2023 |
Xie F, Sun W, Hartwig B, Obenchain DA, Schnell M. Hydrogen-Atom Tunneling in a Homochiral Environment. Angewandte Chemie (International Ed. in English). e202308273. PMID 37467465 DOI: 10.1002/anie.202308273 |
0.627 |
|
2023 |
Dohmen R, Fedosov D, Obenchain DA. Benchmarking the quadrupolar coupling tensor for chlorine to probe weak-bonding interactions. Physical Chemistry Chemical Physics : Pccp. 25: 2420-2429. PMID 36598167 DOI: 10.1039/d2cp04067k |
0.366 |
|
2022 |
Singh H, Pinacho P, Obenchain DA, Quesada-Moreno MM, Schnell M. The many forms of alpha-methoxy phenylacetic acid in the gas phase: flexibility, internal dynamics, and their intramolecular interactions. Physical Chemistry Chemical Physics : Pccp. PMID 36326023 DOI: 10.1039/d2cp03962a |
0.682 |
|
2022 |
Quesada-Moreno MM, Schnell M, Obenchain DA. Rotational analysis of naphthol-aromatic ring complexes stabilized by electrostatic and dispersion interactions. Physical Chemistry Chemical Physics : Pccp. 24: 1598-1609. PMID 34942639 DOI: 10.1039/d1cp04337d |
0.669 |
|
2021 |
Wang H, Chen J, Zheng Y, Obenchain DA, Xu X, Gou Q, Grabow JU, Caminati W. Interaction Types in CH(CH)OH-CO ( = 0-4) Determined by the Length of the Side Alkyl Chain. The Journal of Physical Chemistry Letters. 149-155. PMID 34962816 DOI: 10.1021/acs.jpclett.1c03740 |
0.66 |
|
2021 |
Lu T, Obenchain DA, Zhang J, Grabow JU, Feng G. Van der Waals interactions of the disulfide bond revealed: A microwave spectroscopic study of the diethyl disulfide-argon complex. The Journal of Chemical Physics. 154: 124306. PMID 33810705 DOI: 10.1063/5.0043615 |
0.707 |
|
2020 |
Pinacho P, Obenchain DA, Schnell M. New findings from old data: A semi-experimental value for the eQq of the nitrogen atom. The Journal of Chemical Physics. 153: 234307. PMID 33353346 DOI: 10.1063/5.0033071 |
0.646 |
|
2020 |
Li X, Lu T, Obenchain DA, Zhang J, Herbers S, Grabow JU, Feng G. The Characteristics of Disulfide-Centered Hydrogen Bonds. Angewandte Chemie (International Ed. in English). PMID 33258264 DOI: 10.1002/anie.202014364 |
0.778 |
|
2020 |
Nair KPR, Herbers S, Bailey WC, Obenchain DA, Lesarri A, Grabow JU, Nguyen HVL. Internal rotation and chlorine nuclear quadrupole coupling in 2-chloro-4-fluorotoluene explored by microwave spectroscopy and quantum chemistry. Spectrochimica Acta. Part a, Molecular and Biomolecular Spectroscopy. 247: 119120. PMID 33189979 DOI: 10.1016/j.saa.2020.119120 |
0.819 |
|
2020 |
Gottschalk HC, Poblotzki A, Fatima M, Obenchain DA, Pérez C, Antony J, Auer AA, Baptista L, Benoit DM, Bistoni G, Bohle F, Dahmani R, Firaha D, Grimme S, Hansen A, et al. The first microsolvation step for furans: New experiments and benchmarking strategies. The Journal of Chemical Physics. 152: 164303. PMID 32357787 DOI: 10.1063/5.0004465 |
0.756 |
|
2020 |
Kraus P, Obenchain DA, Herbers S, Wachsmuth D, Frank I, Grabow JU. XeOCS: relatively straightforward? Physical Chemistry Chemical Physics : Pccp. PMID 32101224 DOI: 10.1039/D0Cp00334D |
0.768 |
|
2020 |
Jahn MK, Obenchain DA, Nair KPR, Grabow JU, Vogt N, Demaison J, Godfrey PD, McNaughton D. The puzzling hyper-fine structure and an accurate equilibrium geometry of succinic anhydride. Physical Chemistry Chemical Physics : Pccp. PMID 32083625 DOI: 10.1039/C9Cp06775B |
0.822 |
|
2020 |
Nair KR, Herbers S, Obenchain DA, Grabow J. Internal methyl rotation and molecular structure of trifluorotoluenes: microwave rotational spectra of 2,3,4- and 2,4,5-trifluorotoluene Canadian Journal of Physics. 98: 543-550. DOI: 10.1139/Cjp-2019-0477 |
0.837 |
|
2020 |
Signore JA, Falls CB, Stephens SL, Jiménez-Hoyos CA, Obenchain DA, Cooke S, Novick SE. Microwave spectra of a potential four-fold internal rotor, phenylsulfur pentafluoride Journal of Molecular Structure. 1214: 128130. DOI: 10.1016/J.Molstruc.2020.128130 |
0.76 |
|
2020 |
Obenchain DA, Pinacho P, Zinn S, Schnell M. The low-barrier methyl internal rotation in the rotational spectrum of 3-methylphenylacetylene Journal of Molecular Structure. 1213: 128109. DOI: 10.1016/J.Molstruc.2020.128109 |
0.444 |
|
2019 |
Gao S, Obenchain DA, Lei J, Feng G, Herbers S, Gou Q, Grabow JU. Tetrel bonds and conformational equilibria in the formamide-CO complex: a rotational study. Physical Chemistry Chemical Physics : Pccp. PMID 30869703 DOI: 10.1039/C9Cp00055K |
0.824 |
|
2018 |
Herbers S, Obenchain DA, Kraus P, Wachsmuth D, Grabow JU. Blurring out hydrogen: The dynamical structure of teflic acid. The Journal of Chemical Physics. 148: 194307. PMID 30307200 DOI: 10.1063/1.5027487 |
0.807 |
|
2018 |
Obenchain DA, Spada L, Alessandrini S, Rampino S, Herbers S, Tasinato N, Mendolicchio M, Kraus P, Gauss J, Puzzarini C, Grabow JU, Barone V. On the way to the Sulfur-Sulfur bridge: accurate structural and energetic charac-terization of a homo chalcogen inter-molecular bond. Angewandte Chemie (International Ed. in English). PMID 30303600 DOI: 10.1002/Anie.201810637 |
0.824 |
|
2018 |
Luková K, Nesvadba R, Uhlíková T, Obenchain DA, Wachsmuth D, Grabow JU, Urban Š. Ab initio conformational analysis of 1,2,3,4-tetrahydroquinoline and the high-resolution rotational spectrum of its lowest energy conformer. Physical Chemistry Chemical Physics : Pccp. PMID 29770426 DOI: 10.1039/C8Cp00953H |
0.822 |
|
2018 |
Kraus P, Obenchain DA, Frank I. Benchmark-Quality Semi-Experimental Structural Parameters of Van Der Waals Complexes. The Journal of Physical Chemistry. A. PMID 29301068 DOI: 10.1021/Acs.Jpca.7B10797 |
0.679 |
|
2018 |
Herbers S, Obenchain DA, Lengsfeld KG, Kuper H, Becker JA, Grabow J. Thermal self polymerization investigated by microwave molecular spectroscopy – Rotational characterization of the methyl methacrylate dimer Journal of Molecular Spectroscopy. 351: 49-54. DOI: 10.1016/J.Jms.2018.07.007 |
0.807 |
|
2018 |
Herbers S, Wachsmuth D, Obenchain DA, Grabow J. Rotational characterization of methyl methacrylate: Internal dynamics and structure determination Journal of Molecular Spectroscopy. 343: 96-101. DOI: 10.1016/J.Jms.2017.10.006 |
0.81 |
|
2018 |
Nair KR, Herbers S, Obenchain DA, Grabow J, Lesarri A. The low internal rotation barriers of halogenated toluenes: Rotational spectrum of 2,4-difluorotoluene Journal of Molecular Spectroscopy. 344: 21-26. DOI: 10.1016/J.Jms.2017.10.003 |
0.835 |
|
2017 |
Obenchain DA, Frank DS, Grubbs GS, Pickett HM, Novick SE. The covalent interaction between dihydrogen and gold: A rotational spectroscopic study of H2-AuCl. The Journal of Chemical Physics. 146: 204302. PMID 28571327 DOI: 10.1063/1.4983042 |
0.666 |
|
2017 |
Hansen N, Wullenkord J, Obenchain DA, Graf I, Kohse-Höinghaus K, Grabow J. Microwave spectroscopic detection of flame-sampled combustion intermediates Rsc Advances. 7: 37867-37872. DOI: 10.1039/C7Ra06483G |
0.623 |
|
2017 |
Arsenault EA, Obenchain DA, Orellana W, Novick SE. Nuclear quadrupole coupling in SiH2I2 due to the presence of two iodine nuclei Journal of Molecular Spectroscopy. 338: 72-76. DOI: 10.1016/J.Jms.2017.06.001 |
0.652 |
|
2017 |
Arsenault EA, Obenchain DA, Blake TA, Cooke S, Novick SE. A study of the conformational isomerism of 1-iodobutane by high resolution rotational spectroscopy Journal of Molecular Spectroscopy. 335: 17-22. DOI: 10.1016/J.Jms.2017.03.014 |
0.77 |
|
2016 |
Long BE, Arsenault EA, Obenchain DA, Choi YJ, Ocola EJ, Laane J, Pringle WC, Cooke SA. Microwave Spectra, Structure, and Ring Puckering Vibration of Octafluorocyclopentene. The Journal of Physical Chemistry. A. PMID 27700086 DOI: 10.1021/Acs.Jpca.6B07554 |
0.544 |
|
2016 |
Arsenault EA, Obenchain DA, Choi YJ, Blake TA, Cooke SA, Novick SE. A Study of 2-iodobutane by Rotational Spectroscopy. The Journal of Physical Chemistry. A. PMID 27556339 DOI: 10.1021/Acs.Jpca.6B06938 |
0.783 |
|
2016 |
Kim J, Jang H, Ka S, Obenchain DA, Peebles RA, Peebles SA, Oh JJ. Microwave spectrum of 1-bromobutane Journal of Molecular Spectroscopy. 328: 50-58. DOI: 10.1016/J.Jms.2016.08.004 |
0.807 |
|
2016 |
Duong CH, Obenchain DA, Cooke S, Novick SE. Rotational spectroscopy of 2H,3H-perfluoropentane Journal of Molecular Spectroscopy. 324: 53-55. DOI: 10.1016/J.Jms.2016.04.008 |
0.612 |
|
2016 |
Grubbs G, Frank DS, Obenchain DA, Cooke S, Novick SE. The pure rotational spectrum of a Claisen rearrangement precursor Allyl Phenyl Ether using CP-FTMW spectroscopy Journal of Molecular Spectroscopy. 324: 1-5. DOI: 10.1016/J.Jms.2016.04.001 |
0.735 |
|
2015 |
Grubbs GS, Obenchain DA, Frank DS, Novick SE, Cooke SA, Serrato A, Lin W. A Study of the Monohydrate and Dihydrate Complexes of Perfluoropropionic Acid Using Chirped-Pulse Fourier Transform Microwave (CP-FTMW) Spectroscopy. The Journal of Physical Chemistry. A. 119: 10475-80. PMID 26421936 DOI: 10.1021/Acs.Jpca.5B08347 |
0.743 |
|
2015 |
Obenchain DA, Frank DS, Novick SE, Klemperer W. The position of deuterium in HOD-NNO as determined by structural and nuclear quadrupole coupling constants. The Journal of Chemical Physics. 143: 084301. PMID 26328837 DOI: 10.1063/1.4928687 |
0.745 |
|
2015 |
Grubbs GS, Obenchain DA, Pickett HM, Novick SE. Erratum: "H2-AgCl: A spectroscopic study of a dihydrogen complex" [J. Chem. Phys. 141, 114306 (2014)]. The Journal of Chemical Physics. 143: 029901. PMID 26178133 DOI: 10.1063/1.4926540 |
0.6 |
|
2015 |
Lin W, Wu A, Lu X, Tang X, Obenchain DA, Novick SE. Internal dynamics in the molecular complex of CF3CN and H2O. Physical Chemistry Chemical Physics : Pccp. 17: 17266-70. PMID 26073642 DOI: 10.1039/C5Cp01550B |
0.71 |
|
2014 |
Grubbs GS, Obenchain DA, Pickett HM, Novick SE. H₂-AgCl: a spectroscopic study of a dihydrogen complex. The Journal of Chemical Physics. 141: 114306. PMID 25240357 DOI: 10.1063/1.4895904 |
0.656 |
|
2014 |
Christenholz CL, Obenchain DA, Peebles RA, Peebles SA. Rotational spectroscopic studies of C-H · · · F interactions in the vinyl fluoride · · · difluoromethane complex. The Journal of Physical Chemistry. A. 118: 1610-6. PMID 24564454 DOI: 10.1021/Jp500312R |
0.807 |
|
2012 |
Guirgis GA, Overby JS, Palmer MH, Peebles RA, Peebles SA, Elmuti LF, Obenchain DA, Pate BH, Seifert NA. Molecular structure of methyldifluoroisocyanato silane: a combined microwave spectral and theoretical study. The Journal of Physical Chemistry. A. 116: 7822-9. PMID 22757670 DOI: 10.1021/Jp302519H |
0.827 |
|
2012 |
Durig JR, Panikar SS, Obenchain DA, Bills BJ, Lohan PM, Peebles RA, Peebles SA, Groner P, Guirgis GA, Johnston MD. Microwave, infrared and Raman spectra, r0 structural parameters, ab initio calculations and vibrational assignment of 1-fluoro-1-silacyclopentane. The Journal of Chemical Physics. 136: 044306. PMID 22299870 DOI: 10.1063/1.3673889 |
0.783 |
|
2012 |
Bills BJ, Carroll DM, Elliott AA, Obenchain DA, Peebles SA, Peebles RA. Microwave spectrum and structure of pentafluorobenzene Journal of Molecular Structure. 1023: 149-153. DOI: 10.1016/J.Molstruc.2012.04.067 |
0.806 |
|
2012 |
Christenholz CL, Obenchain DA, Peebles SA, Peebles RA. Reduced bandwidth chirped-pulse microwave spectroscopy for analysis of weakly bound dimers: Rotational spectrum and structural analysis of CH 2ClF⋯FHCCH 2 Journal of Molecular Spectroscopy. 280: 61-67. DOI: 10.1016/J.Jms.2012.06.003 |
0.785 |
|
2012 |
Grubbs GS, Serrato A, Obenchain DA, Cooke SA, Novick SE, Lin W. The rotational spectrum of perfluoropropionic acid Journal of Molecular Spectroscopy. 275: 1-4. DOI: 10.1016/J.Jms.2012.04.003 |
0.729 |
|
2011 |
Obenchain DA, Bills BJ, Christenholz CL, Elmuti LF, Peebles RA, Peebles SA, Neill JL, Steber AL. C-H···π interactions in the CHBrF2···HCCH weakly bound dimer. The Journal of Physical Chemistry. A. 115: 12228-34. PMID 21978322 DOI: 10.1021/Jp208603M |
0.817 |
|
2011 |
Stidham HD, Laplante AJ, Oh JJ, Obenchain DA, Peebles SA, Peebles RA, Wurrey CJ, Marrow E, Guirgis GA. Microwave and vibrational spectra, ab initio calculations, conformational stabilities and assignments of the fundamentals of the C s conformer of n-butylsilane Journal of Molecular Structure. 1003: 31-40. DOI: 10.1016/J.Molstruc.2010.07.046 |
0.784 |
|
2010 |
Guirgis GA, Wang Z, Lirjoni J, Palmer MH, Obenchain DA, Peebles RA, Peebles SA. The molecular structure of difluoroisocyanato silane: A combined microwave spectral and theoretical study Journal of Molecular Structure. 983: 5-11. DOI: 10.1016/J.Molstruc.2010.07.044 |
0.821 |
|
2010 |
Obenchain DA, Elliott AA, Steber AL, Peebles RA, Peebles SA, Wurrey CJ, Guirgis GA. Rotational spectrum of three conformers of 3,3-difluoropentane: Construction of a 480 MHz bandwidth chirped-pulse Fourier-transform microwave spectrometer Journal of Molecular Spectroscopy. 261: 35-40. DOI: 10.1016/J.Jms.2010.03.002 |
0.808 |
|
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