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345 related items for PubMed ID: 17538726

  • 21. Resolving an apparent discrepancy between theory and experiment: spin-spin coupling constants for FCCF.
    Del Bene JE, Provasi PF, Alkorta I, Elguero J.
    Magn Reson Chem; 2008 Nov; 46(11):1003-6. PubMed ID: 18792421
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  • 22. Electric field effects on one-bond indirect spin-spin coupling constants and possible biomolecular perspectives.
    Sahakyan AB, Shahkhatuni AG, Shahkhatuni AA, Panosyan HA.
    J Phys Chem A; 2008 Apr 24; 112(16):3576-86. PubMed ID: 18363392
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  • 23. Quantum chemistry-based NMR spin Hamiltonian parameters of GABA for quantitation in magnetic resonance spectroscopy.
    Allouche AR, Aubert-Frécon M, Graveron-Demilly D.
    Phys Chem Chem Phys; 2007 Jun 28; 9(24):3098-103. PubMed ID: 17612733
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  • 24. Relative importance of first and second derivatives of nuclear magnetic resonance chemical shifts and spin-spin coupling constants for vibrational averaging.
    Dracínský M, Kaminský J, Bour P.
    J Chem Phys; 2009 Mar 07; 130(9):094106. PubMed ID: 19275395
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  • 25. Interaction energies and NMR indirect nuclear spin-spin coupling constants in linear HCN and HNC complexes.
    Provasi PF, Aucar GA, Sanchez M, Alkorta I, Elguero J, Sauer SP.
    J Phys Chem A; 2005 Jul 28; 109(29):6555-64. PubMed ID: 16834002
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  • 26. Constants of motion in NMR spectroscopy.
    Walls JD, Lin YY.
    Solid State Nucl Magn Reson; 2006 Feb 28; 29(1-3):22-9. PubMed ID: 16257517
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  • 27. Indirect nuclear spin-spin coupling constants in 1,2-diboretane-3-ylidene, a homoaromatic system with pi and sigma 3c/2e bonds. Comparison of experimental data with calculations using density functional theory (DFT).
    Wrackmeyer B, Berndt A.
    Magn Reson Chem; 2004 Jun 28; 42(6):490-5. PubMed ID: 15137041
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  • 28. Simulation of steady-state NMR of coupled systems using Liouville space and computer algebra methods.
    Anand CK, Bain AD, Nie Z.
    J Magn Reson; 2007 Dec 28; 189(2):200-8. PubMed ID: 17928248
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  • 33. Different types of hydrogen bonds in 2-substituted pyrroles and 1-vinyl pyrroles as monitored by (1)H, (13)C and (15)N NMR spectroscopy and ab initio calculations.
    Afonin AV, Ushakov IA, Sobenina LN, Stepanova ZV, Petrova OV, Trofimov BA.
    Magn Reson Chem; 2006 Jan 28; 44(1):59-65. PubMed ID: 16259054
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  • 34. Interpretation of indirect nuclear spin-spin couplings in isomers of adenine: novel approach to analyze coupling electron deformation density using localized molecular orbitals.
    Marek R, Krístková A, Malináková K, Tousek J, Marek J, Hocek M, Malkina OL, Malkin VG.
    J Phys Chem A; 2010 Jun 24; 114(24):6689-700. PubMed ID: 20518482
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  • 35. Electronic influences on 3J(C,H) coupling constants via -S-, -S(O)- and -SO2-: their determination, calculation and comparison of detection methods.
    Heydenreich M, Koch A, Kovács J, Tóth G, Kleinpeter E.
    Magn Reson Chem; 2004 Aug 24; 42(8):667-70. PubMed ID: 15248254
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  • 36. Probing (1)J(C-F) and (n)J(F-F) spin-spin coupling constants for fluoroazines: an ab initio theoretical investigation.
    Del Bene JE, Alkorta I, Elguero J.
    J Phys Chem A; 2010 Feb 25; 114(7):2637-43. PubMed ID: 20112975
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  • 37. Paramagnetic Effects in NMR Spectroscopy of Transition-Metal Complexes: Principles and Chemical Concepts.
    Novotny J, Komorovsky S, Marek R.
    Acc Chem Res; 2024 May 21; 57(10):1467-1477. PubMed ID: 38687879
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