Geminal2JCCHSpin−Spin Coupling Constants as Probes of the φ Glycosidic Torsion Angle in Oligosaccharides

13C-Labeled mono- and disaccharides were studied by X-ray crystallography and solid-state 13C NMR to determine the dependence of 2JC1,C3 in aldopyranosyl rings on the C1–C2–O2–H torsion angle, θ2, involving C2 of the C1–C2–C3 coupling pathway.

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Vibrational and thermal averaging of the indirect nuclear spin-spin coupling constants of CH4, SiH4, GeH4 and SnH4

Molecular Physics ◽

10.1080/00268979709482780 ◽

1997 ◽

Vol 91 (5) ◽

pp. 897-907 ◽

Cited By ~ 5

Author(s):

SHEELA KIRPEKAR ◽

THOMAS ENEVOLDSEN ◽

JENS ODDERSHEDE ◽

WILLIAM RAYNES

Keyword(s):

Nuclear Spin ◽

Coupling Constants ◽

Spin Coupling ◽

Spin Coupling Constants ◽

Spin Spin Coupling

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Recent advances in computational 31 P NMR: Part 2. Spin-spin coupling constants

Magnetic Resonance in Chemistry ◽

10.1002/mrc.4973 ◽

2019 ◽

Vol 58 (6) ◽

pp. 500-511

Author(s):

Leonid B. Krivdin

Keyword(s):

Coupling Constants ◽

Spin Coupling ◽

Recent Advances ◽

Spin Coupling Constants ◽

Spin Spin Coupling

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BIRD-J -resolved HMBC and BIRD-high-resolution HMBC pulse sequences for measuring heteronuclear long-range coupling constants and proton-proton spin coupling constants in complicated spin systems

Magnetic Resonance in Chemistry ◽

10.1002/mrc.2702 ◽

2011 ◽

Vol 49 (2) ◽

pp. 53-58 ◽

Cited By ~ 9

Author(s):

Kazuo Furihata ◽

Mitsuru Tashiro ◽

Haruo Seto

Keyword(s):

High Resolution ◽

Long Range ◽

Pulse Sequences ◽

Spin Systems ◽

Proton Spin ◽

Coupling Constants ◽

Spin Coupling ◽

Proton Proton ◽

Spin Coupling Constants

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Anisotropies in spin—spin coupling constants and chemical shifts as determined from the NMR spectra of molecules oriented by liquid crystal solvents

Progress in Nuclear Magnetic Resonance Spectroscopy ◽

10.1016/0079-6565(82)80004-6 ◽

1982 ◽

Vol 15 (3) ◽

pp. 249-290 ◽

Cited By ~ 93

Author(s):

J. Lounila ◽

J. Jokisaari

Keyword(s):

Liquid Crystal ◽

Nmr Spectra ◽

Chemical Shifts ◽

Coupling Constants ◽

Spin Coupling ◽

Spin Coupling Constants ◽

Spin Spin Coupling

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Basis set dependence of 1H–X spin–spin coupling constants in non-empirical pure DFT framework, X = 1H, 13C, 19F, 35Cl: Case of CHCl=CH–CF3 stereoisomers

AIP Advances ◽

10.1063/5.0043005 ◽

2021 ◽

Vol 11 (3) ◽

pp. 035113

Author(s):

Olivier Holtomo ◽

Mama Nsangou ◽

Ousmanou Motapon

Keyword(s):

Coupling Constants ◽

Spin Coupling ◽

Basis Set ◽

Spin Coupling Constants ◽

Spin Spin Coupling

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Phosphorus–fluorine compounds. Part XII. Phosphorus-31 and fluorine-19 nuclear magnetic resonance studies on fluorophosphine molybdenum complexes. Evaluation of geminal phosphorus–phosphorus spin-coupling constants, |2JPP′|, in cis-disubstituted octahedral complexes

Journal of the Chemical Society A Inorganic Physical Theoretical ◽

10.1039/j19690001082 ◽

1969 ◽

Vol 0 (0) ◽

pp. 1082-1087 ◽

Cited By ~ 20

Author(s):

C. G. Barlow ◽

J. F. Nixon ◽

J. R. Swain

Keyword(s):

Nuclear Magnetic Resonance ◽

Magnetic Resonance ◽

Coupling Constants ◽

Spin Coupling ◽

Molybdenum Complexes ◽

Magnetic Resonance Studies ◽

Fluorine Compounds ◽

Spin Coupling Constants ◽

In Cis ◽

Nuclear Magnetic

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Structural Characterization of Natural Products By Means of Quantum Chemical Calculations of NMR Parameters: New insights

Organic Chemistry Frontiers ◽

10.1039/d1qo00034a ◽

2021 ◽

Author(s):

Fabio Luiz Paranhos Costa ◽

Ana Carolina Ferreira de Albuquerque ◽

Rodolfo Goetze Fiorot ◽

Luciano Morais Lião ◽

Lucas Haidar Martorano ◽

...

Keyword(s):

Natural Products ◽

Structural Characterization ◽

Quantum Chemical ◽

Chemical Shifts ◽

Coupling Constants ◽

Spin Coupling ◽

Nmr Parameters ◽

Spin Coupling Constants ◽

Spin Spin Coupling

The calculation of NMR parameters for natural products was pioneered by Bifulco and coworkers in 2002. Since then, modelling 1H and 13C chemical shifts and spin-spin coupling constants for this...

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