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2004 | 3 |
2006 | 1 |
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Page 1
A graphical tool for the prediction of vicinal proton-proton 3J(HH) coupling constants.
J Chem Inf Comput Sci. 2004 Sep-Oct;44(5):1680-5. doi: 10.1021/ci049913t.
J Chem Inf Comput Sci. 2004.
PMID: 15446826
Experimental and theoretical study of hyperconjugative interaction effects on NMR 1J(CH) scalar couplings.
Contreras RH, Esteban AL, Díez E, Della EW, Lochert IJ, Dos Santos FP, Tormena CF.
Contreras RH, et al. Among authors: diez e.
J Phys Chem A. 2006 Mar 30;110(12):4266-75. doi: 10.1021/jp0555201.
J Phys Chem A. 2006.
PMID: 16553380
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Experimental and DFT studies on the transmission mechanisms of analogous NMR JCH and JCC couplings in 1-X- and 1-X-3-methylbicyclo[1.1.1]-pentanes.
Contreras RH, Esteban AL, Díez E, Lochert IJ, Della EW, Tormena CF.
Contreras RH, et al. Among authors: diez e.
Magn Reson Chem. 2007 Jul;45(7):572-7. doi: 10.1002/mrc.2009.
Magn Reson Chem. 2007.
PMID: 17534878
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Substituent effects on scalar J(13C, 13C) couplings in pyrimidines. An experimental and DFT study.
de Kowalewski DG, Díez E, Esteban AL, Barone V, Peralta JE, Contreras RH.
de Kowalewski DG, et al. Among authors: diez e.
Magn Reson Chem. 2004 Nov;42(11):938-43. doi: 10.1002/mrc.1426.
Magn Reson Chem. 2004.
PMID: 15386555
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Influence of sigma-hyperconjugative interactions on 13C substituent chemical shifts: experimental and theoretical study in 1-X,3-CH3-bicyclo[1.1.1]pentanes.
Contreras RH, Esteban AL, Díez E, Della EW, Lochert IJ.
Contreras RH, et al. Among authors: diez e.
Magn Reson Chem. 2004 Oct;42 Spec no:S202-6. doi: 10.1002/mrc.1471.
Magn Reson Chem. 2004.
PMID: 15366055
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