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  • Analytical Chemistry and Spectroscopy  (3)
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  • Analytical Chemistry and Spectroscopy  (3)
  • Chemistry  (3)
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  • 1
    ISSN: 0030-4921
    Keywords: Chemistry ; Analytical Chemistry and Spectroscopy
    Source: Wiley InterScience Backfile Collection 1832-2000
    Topics: Chemistry and Pharmacology
    Notes: 13C substituent shifts in para-substituted phenyl and 2-phenylethenyl carbenium ions have been studied within the general model of para-disubstituted benzenes X—C6H4—Y. Large variations are observed for the ipso shifts induced by the Y substituents (Y = NO2. … OCH3) depending upon the electron demand at the remote carbenium centre. A good representation of these substituent-substituent interactions is obtained by a treatment derived from ‘proportionality relationships’, where the deviations from strict additivity are factorized into two terms characterizing, respectively, the influence of the fixed X group on the ring and the susceptibility of the incoming Y substituent. Continuity of the ipso shift variations in an extended range is demonstrated, without break-off between neutral polarized systems or ions as the electronic influence of the fixed X group increases.
    Additional Material: 2 Ill.
    Type of Medium: Electronic Resource
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  • 2
    Electronic Resource
    Electronic Resource
    Chichester : Wiley-Blackwell
    Organic Magnetic Resonance 16 (1981), S. 247-249 
    ISSN: 0030-4921
    Keywords: Chemistry ; Analytical Chemistry and Spectroscopy
    Source: Wiley InterScience Backfile Collection 1832-2000
    Topics: Chemistry and Pharmacology
    Notes: Experimental solvent effects on 13C and 17O chemical shifts of acetone, and 13C chemical shifts of acetonitrile are compared with theoretical calculations by Jallali-Heravi and Webb (solvaton model). Calculated values are, generally, in agreement with experimental results for atoms belonging to polar groups, but not for methyl carbons for which van der Waals interaction effects are predominant.
    Additional Material: 1 Tab.
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  • 3
    Electronic Resource
    Electronic Resource
    Chichester : Wiley-Blackwell
    Organic Magnetic Resonance 23 (1985), S. 460-467 
    ISSN: 0749-1581
    Keywords: Chemistry ; Analytical Chemistry and Spectroscopy
    Source: Wiley InterScience Backfile Collection 1832-2000
    Topics: Chemistry and Pharmacology
    Notes: The dynamics of the molecular rotation of 2(1H)-pyridone and 1-methyl-2(1H)-pyridone in toluene, carbon tetrachloride, methanol and water have been investigated at 305 K by 13C and 2H NMR. Both chemical shifts and relaxation times show that 2-pyridonc forms stable hydrogen-bonded complexes in methanol and in water, reorienting as a complete unit and taking with it two solvent molecules. These solvated species are stable within the liquid-state temperature range, and reorient according to the hydrodynamic law as indicated by the 14N line width measurements. It follows that the lifetimes of these complexes are always greater by at least an order of magnitude than the rotational correlation time scale. Analysis of the 14N quadrupole coupling constants and the rotational anisotropy support the structure and stability of these complexes.
    Additional Material: 2 Ill.
    Type of Medium: Electronic Resource
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