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Journal Abstract Search

603 related items for PubMed ID: 16839005

  • 21.
    ; . PubMed ID:
    [No Abstract] [Full Text] [Related]

  • 22. Low-temperature NMR studies of the structure and dynamics of a novel series of acid-base complexes of HF with collidine exhibiting scalar couplings across hydrogen bonds.
    Shenderovich IG, Tolstoy PM, Golubev NS, Smirnov SN, Denisov GS, Limbach HH.
    J Am Chem Soc; 2003 Sep 24; 125(38):11710-20. PubMed ID: 13129376
    [Abstract] [Full Text] [Related]

  • 23. A theoretical structural analysis of the factors that affect (1)J(NH), (1h)J(NH) and (2h)J(NN) in N-H...N hydrogen-bonded complexes.
    Alkorta I, Blanco F, Elguero J.
    Magn Reson Chem; 2009 Mar 24; 47(3):249-56. PubMed ID: 19097158
    [Abstract] [Full Text] [Related]

  • 24. Can changes in one-bond spin-spin coupling constants in acids be related to gas-phase proton affinities of bases?
    Del Bene JE, Elguero J.
    J Phys Chem A; 2007 Jul 19; 111(28):6443-8. PubMed ID: 17580837
    [Abstract] [Full Text] [Related]

  • 25. Ab initio study of nonadditivity effects: spin-spin coupling constants for tetrafluoroethene in ternary pi complexes.
    Del Bene JE, Alkorta I, Elguero J.
    J Phys Chem A; 2010 Mar 18; 114(10):3713-7. PubMed ID: 20163164
    [Abstract] [Full Text] [Related]

  • 26. Spin-spin coupling across intermolecular F-Cl...N halogen bonds.
    Del Bene JE, Alkorta I, Elguero J.
    J Phys Chem A; 2008 Aug 28; 112(34):7925-9. PubMed ID: 18680268
    [Abstract] [Full Text] [Related]

  • 27. Ab initio EOM-CCSD investigation of one-bond C-C, N-C, and N-N spin-spin coupling constants in fluoroazines.
    Del Bene JE, Alkorta I, Elguero J.
    J Phys Chem A; 2010 Apr 22; 114(15):5205-10. PubMed ID: 20353184
    [Abstract] [Full Text] [Related]

  • 28. Spin-spin coupling across intramolecular N-H(+)-N hydrogen bonds in models for proton sponges: an ab initio investigation.
    Del Bene JE, Alkorta I, Elguero J.
    Magn Reson Chem; 2008 May 22; 46(5):457-63. PubMed ID: 18297741
    [Abstract] [Full Text] [Related]

  • 29. 19F-19F spin-spin coupling constant surfaces for (HF)2 clusters: the orientation and distance dependence of the sign and magnitude of J(F-F).
    Del Bene JE, Elguero J, Alkorta I, Yanez M, Mo O.
    J Chem Phys; 2004 Feb 15; 120(7):3237-43. PubMed ID: 15268477
    [Abstract] [Full Text] [Related]

  • 30. 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
    [Abstract] [Full Text] [Related]

  • 31. Comparative analysis of hydrogen bonding with participation of the nitrogen, oxygen and sulfur atoms in the 2(2'-heteroaryl)pyrroles and their trifluoroacetyl derivatives based on the 1H, 13C, 15N spectroscopy and DFT calculations.
    Afonin AV, Vashchenko AV, Ushakov IA, Zorina NV, Schmidt EY.
    Magn Reson Chem; 2008 May 25; 46(5):441-7. PubMed ID: 18318452
    [Abstract] [Full Text] [Related]

  • 32. An ab initio study of 15N-11B spin-spin coupling constants for borazine and selected derivatives.
    Del Bene JE, Elguero J, Alkorta I, Yañez M, Mó O.
    J Phys Chem A; 2006 Aug 17; 110(32):9959-66. PubMed ID: 16898700
    [Abstract] [Full Text] [Related]

  • 33. Theoretical study of bifurcated hydrogen bonding effects on the 1J(N,H), 1hJ(N,H), 2hJ(N,N) couplings and 1H, 15N shieldings in model pyrroles.
    Afonin AV, Vashchenko AV.
    Magn Reson Chem; 2010 Apr 17; 48(4):309-17. PubMed ID: 20198609
    [Abstract] [Full Text] [Related]

  • 34. Using (FH)2 and (FH)3 to Bridge the σ-Hole and the Lone Pair at P in Complexes with H2 XP, for X=CH3 , OH, H, CCH, F, Cl, NC, and CN.
    Del Bene JE, Alkorta I, Elguero J.
    Chemphyschem; 2016 May 18; 17(10):1475-85. PubMed ID: 26888567
    [Abstract] [Full Text] [Related]

  • 35. Structural and electronic effects on one-bond spin-spin coupling constants 1J(B-N), 1J(B-H), and 1J(B-F) for complexes of nitrogen bases with BH3 and its fluoro-substituted derivatives.
    Del Bene JE, Alkorta I, Elguero J, Mó O, Yáñez M.
    J Phys Chem A; 2010 Dec 09; 114(48):12775-9. PubMed ID: 21067128
    [Abstract] [Full Text] [Related]

  • 36. Characterization of fluxional hydrogen-bonded complexes of acetic acid and acetate by NMR: geometries and isotope and solvent effects.
    Tolstoy PM, Schah-Mohammedi P, Smirnov SN, Golubev NS, Denisov GS, Limbach HH.
    J Am Chem Soc; 2004 May 05; 126(17):5621-34. PubMed ID: 15113234
    [Abstract] [Full Text] [Related]

  • 37. Study of the nature of improper blue-shifting hydrogen bonding and standard hydrogen bonding in the X3CH...OH2 and XH...OH2 complexes (X = F, Cl, Br, I): A correlated Ab initio study.
    Zierkiewicz W, Michalska D, Havlas Z, Hobza P.
    Chemphyschem; 2002 Jun 17; 3(6):511-8. PubMed ID: 12465490
    [Abstract] [Full Text] [Related]

  • 38. One-step and two-step spin-crossover iron(II) complexes of ((2-methylimidazol-4-yl)methylidene)histamine.
    Sato T, Nishi K, Iijima S, Kojima M, Matsumoto N.
    Inorg Chem; 2009 Aug 03; 48(15):7211-29. PubMed ID: 19722691
    [Abstract] [Full Text] [Related]

  • 39.
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  • 40. HC[triple bond]P and H3C-C[triple bond]P as proton acceptors in protonated complexes containing two phosphorus bases: structures, binding energies, and spin-spin coupling constants.
    Alkorta I, Elguero J, Bene JE.
    J Phys Chem A; 2007 Oct 04; 111(39):9924-30. PubMed ID: 17760429
    [Abstract] [Full Text] [Related]

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