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Magnetic Resonance in Chemistry, ISSN 0749-1581, 02/2017, Volume 55, Issue 2, pp. 154 - 156
Measurement of 1H‐15N and 13C‐15N coupling constants at natural abundance is demonstrated to be a reliable and generic method to determine the configuration of... 
HCNMBC | 13C‐15N coupling constant | HSQMBC | oxime | configuration | 1H‐15N coupling constant | 13C-15N coupling constant | 1H-15N coupling constant
Journal Article
Journal of Magnetic Resonance, ISSN 1090-7807, 05/2014, Volume 242, pp. 33 - 40
[Display omitted] •Measurement of individual 1J(CH) coupling constants in diastereotopic CH2 groups.•Simultaneous sign-sensitive determination of 1J(CHA),... 
One-bond proton–carbon coupling constants | Methylene spin systems | Inverse INEPT | E.COSY | Two-bond proton–proton coupling constants | Residual dipolar couplings | Two-bond proton-proton coupling constants | One-bond proton-carbon coupling constants
Journal Article
Journal of Magnetism and Magnetic Materials, ISSN 0304-8853, 04/2015, Volume 391, pp. 166 - 171
Abstract Antiferromagnetic Mn 3 O 4 in spinel structure was investigated employing the Density Functional Theory at different hybrid functionals with default... 
Coupling constants | Hybrid functionals | DFT
Journal Article
Physical Review Letters, ISSN 0031-9007, 05/2013, Volume 110, Issue 19, p. 192001
We introduce a generalization of the conventional renormalization schemes used in dimensional regularization, which illuminates the renormalization scheme and... 
PHYSICS, MULTIDISCIPLINARY | TOTAL CROSS-SECTION | STRONG-COUPLING-CONSTANT
Journal Article
Chemical Physics Letters, ISSN 0009-2614, 07/2016, Volume 655-656, pp. 115 - 119
Journal Article
Tetrahedron Letters, ISSN 0040-4039, 10/2016, Volume 57, Issue 42, pp. 4727 - 4729
[Display omitted] •Misassigned structure of a sesquiterpene meridane is computationally corrected.•Besides chemical shifts, JH–H and JC–H are computed with rff... 
Longipinanes | Structure revision | Nuclear spin–spin coupling constants | Relativistic force field (DU8c) | Meridane | WAGNER-MEERWEIN REARRANGEMENTS | PROTON COUPLING-CONSTANTS | H-1-NMR SPECTRA | CHEMISTRY, ORGANIC | Nuclear spin-spin coupling constants | SKELETON | Spin coupling
Journal Article
International Journal of Modern Physics A, ISSN 0217-751X, 12/2017, Volume 32, Issue 35
Journal Article
Journal of Fluorine Chemistry, ISSN 0022-1139, 01/2013, Volume 145, pp. 51 - 57
The 5J(F,C) coupling constants between the fluorines of the BF2 group and carbon of the side substituent in the BODIPY fluorophores can serve as a reliable... 
19F–13C coupling constants | QTAIM analysis | 19F–1H coupling constants | Conformational analysis | NBO analysis | H coupling constants | C coupling constants
Journal Article
Journal of Magnetic Resonance, ISSN 1090-7807, 11/2016, Volume 272, pp. 10 - 19
Journal Article
ChemPhysChem, ISSN 1439-4235, 08/2018, Volume 19, Issue 15, pp. 1886 - 1894
Ab initio MP2/aug’‐cc‐pVTZ calculations have been carried out to investigate chalcogen‐bond formation through the σ‐hole at S and tetrel‐bond formation through... 
tetrel bonds | IR spectra | chalcogens | bond energy | spin-spin coupling constants | CORRELATED MOLECULAR CALCULATIONS | AB-INITIO | WEAK-INTERACTIONS | CO2 | PHYSICS, ATOMIC, MOLECULAR & CHEMICAL | CHEMISTRY, PHYSICAL | HETEROCYCLIC CARBENES | ELECTRON-PAIR DONORS | BODY PERTURBATION-THEORY | SPIN COUPLING-CONSTANTS | CARBONYL SULFIDE | GAUSSIAN-BASIS SETS | Spin coupling | Force and energy
Journal Article
Chemical Communications, ISSN 1359-7345, 12/2014, Volume 50, Issue 98, pp. 15597 - 15600
A new 1D NMR experiment cited as 'Quick G-SERF', which re-introduces selective proton-proton scalar interactions in a pure shift spectrum during real time data... 
SERF | STEREOCHEMICAL ANALYSIS | SPECTROSCOPY | CHEMISTRY, MULTIDISCIPLINARY | COUPLING-CONSTANTS | CONFIGURATION
Journal Article
by Sirunyan, A.M and Tumasyan, A and Adam, W and Asilar, E and Bergauer, T and Brandstetter, J and Brondolin, E and Dragicevic, M and Erö, J and Flechl, M and Friedl, M and Frühwirth, R and Ghete, V.M and Hartl, C and Hörmann, N and Hrubec, J and Jeitler, M and König, A and Krätschmer, I and Liko, D and Matsushita, T and Mikulec, I and Rabady, D and Rad, N and Rahbaran, B and Rohringer, H and Schieck, J and Strauss, J and Waltenberger, W and Wulz, C.-E and Dvornikov, O and Makarenko, V and Mossolov, V and Suarez Gonzalez, J and Zykunov, V and Shumeiko, N and Alderweireldt, S and De Wolf, E.A and Janssen, X and Lauwers, J and Van De Klundert, M and Van Haevermaet, H and Van Mechelen, P and Van Remortel, N and Van Spilbeeck, A and Zeid, S. Abu and Blekman, F and D’Hondt, J and Daci, N and De Bruyn, I and Deroover, K and Lowette, S and Moortgat, S and Moreels, L and Olbrechts, A and Python, Q and Skovpen, K and Tavernier, S and Van Doninck, W and Van Mulders, P and Van Parijs, I and Brun, H and Clerbaux, B and De Lentdecker, G and Delannoy, H and Fasanella, G and Favart, L and Goldouzian, R and Grebenyuk, A and Karapostoli, G and Lenzi, T and Léonard, A and Luetic, J and Maerschalk, T and Marinov, A and Randle-conde, A and Seva, T and Vander Velde, C and Vanlaer, P and Vannerom, D and Yonamine, R and Zenoni, F and Zhang, F and Cornelis, T and Dobur, D and Fagot, A and Gul, M and Khvastunov, I and Poyraz, D and Salva, S and Schöfbeck, R and Tytgat, M and Van Driessche, W and Zaganidis, N and Bakhshiansohi, H and Bondu, O and Brochet, S and Bruno, G and Caudron, A and De Visscher, S and ...
European Physical Journal C, ISSN 1434-6044, 11/2017, Volume 77, Issue 11
Journal Article
Journal of Magnetic Resonance, ISSN 1090-7807, 03/2019, Volume 300, pp. 76 - 83
Journal Article
Journal of Quantitative Spectroscopy and Radiative Transfer, ISSN 0022-4073, 09/2019, Volume 235, pp. 162 - 179
•Observed lines in the 354 lines of I I in the infrared region.•Hfs measured on 224 lines.•Hfs measured on 172 lines for the first time.•Hfs constants... 
Hyperfine structure | Electric quadrupole coupling constant | Iodine atom | Magnetic dipole coupling constant | Emission spectra | Fourier transform spectrometer | Infrared region
Journal Article