Prediction of vicinal proton–proton coupling constants3JHHfrom density functional theory calculations-Reference-Cited by-同舟云学术

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Prediction of vicinal proton–proton coupling constants3JHHfrom density functional theory calculations

Published:2005-05-10 Issue:9 Volume:103 Page:1307-1326
ISSN:0026-8976
Container-title:Molecular Physics
language:en
Short-container-title:Molecular Physics

Author:

Díez * Ernesto,Casanueva Jorge,San Fabián Jesus,Esteban Angel L.,Galache Maria P.,Barone Veronica,Peralta Juan E.,Contreras Rubén H.

Publisher

Informa UK Limited

Subject

Physical and Theoretical Chemistry,Condensed Matter Physics,Molecular Biology,Biophysics

Link

http://www.tandfonline.com/doi/pdf/10.1080/00268970412331333131

Reference66 articles.

1. Contact Electron‐Spin Coupling of Nuclear Magnetic Moments

2. Vicinal Proton Coupling in Nuclear Magnetic Resonance

3. A Graphical Tool for the Prediction of Vicinal Proton−Proton 3JHH Coupling Constants

4. The relationship between proton-proton NMR coupling constants and substituent electronegativities—I

5. Altona CEncyclopedia of NMRGrant and R.K. Harris (Eds) pp. 4909–4923WileyNew York 1996

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2. Relativistic Force Field: Parametrization of 13C–1H Nuclear Spin–Spin Coupling Constants;The Journal of Organic Chemistry;2015-10-08

3. Minimalist Relativistic Force Field: Prediction of Proton–Proton Coupling Constants in 1H NMR Spectra Is Perfected with NBO Hybridization Parameters;The Journal of Organic Chemistry;2015-04-30

4. Relativistic Force Field: Parametric Computations of Proton–Proton Coupling Constants in 1H NMR Spectra;The Journal of Organic Chemistry;2014-08-26

5. Natural bond orbital/natural J-coupling study of vicinal couplings;Journal of Molecular Modeling;2014-06-20

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