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  • 1
    Electronic Resource
    Electronic Resource
    Chichester : Wiley-Blackwell
    Organic Magnetic Resonance 26 (1988), S. 281-286 
    ISSN: 0749-1581
    Keywords: Ribonucleosides ; Solid-state ; 13C NMR ; Residual 13C ; 14N dipolar coupling ; Chemistry ; Analytical Chemistry and Spectroscopy
    Source: Wiley InterScience Backfile Collection 1832-2000
    Topics: Chemistry and Pharmacology
    Notes: 13C CP/MAS NMR spectra of nitrogen-containing compounds often show complex signals when recorded at low field strengths. This effect is due to the 13C, 14N residual dipolar coupling which is not averaged to zero by magic-angle spinning. Solid-state 13C NMR spectra at 25 MHz of ribonucleosides are analysed on the basis of the isotropic chemical shifts measured at 50 MHz, together with the asymmetric splittings caused by the presence of 14N calculated using a first-order equation. X-ray diffraction and NQR data, together with several assumptions regarding the quadrupole tensor at each 14N site, are used to obtain a successful spectral simulation.
    Additional Material: 5 Ill.
    Type of Medium: Electronic Resource
    Library Location Call Number Volume/Issue/Year Availability
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  • 2
    Electronic Resource
    Electronic Resource
    Chichester : Wiley-Blackwell
    Organic Magnetic Resonance 28 (1990), S. S29 
    ISSN: 0749-1581
    Keywords: CP-MAS NMR ; spectroscopy ; 1,5-Proton shifts ; Solid porphyrins, arylazonaphthols ; 1,3-diketones ; Chemistry ; Analytical Chemistry and Spectroscopy
    Source: Wiley InterScience Backfile Collection 1832-2000
    Topics: Chemistry and Pharmacology
    Notes: High-resolution CP-MAS NMR analyses of solid organic samples where fast 1,5-proton shifts occur between tautomeric structures are described. Attention is focused on the available techniques to establish the existence of such reactions. Dynamic interconversion is unambiguously characterized where complete line shape study involving multiple sites is possible. Reconciliation between this information and that provided by diffraction methods is stressed, the latter often suggesting the presence of unique, static structures in crystals. In cases in which reactions are in the fast limit at all accessible temperatures, the combination of CP-MAS spectra, x-ray or neutron diffraction data at variable temperatures and theoretical calculations of molecular properties may be helpful in establishing double minimum potential wells for the proton motion. Among these, porphyrins, arylazonaphthols and 1,3-diketones in rigid and non-rigid skeletons are interesting examples of current interest.
    Additional Material: 1 Ill.
    Type of Medium: Electronic Resource
    Library Location Call Number Volume/Issue/Year Availability
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  • 3
    ISSN: 0749-1581
    Keywords: NMR ; solid-state NMR ; magic angle spinning ; quadrupolar interactions ; perturbation theory ; bromine-carbon coupling ; Chemistry ; Analytical Chemistry and Spectroscopy
    Source: Wiley InterScience Backfile Collection 1832-2000
    Topics: Chemistry and Pharmacology
    Notes: Splittings in the 13C cross-polarization magic angle spinning spectra of 1, 4-dibromobenzene and 4-bromo-3, 5-dimethylpyrazole are reported. They arise from (79,81Br, 13C) interactions influenced by the quadrupolar nature of the bromine nuclei. They are analysed using both ‘inverse’ perturbation and exact theories to yield data on both isotropic and anisotropic coupling, including the signs. The spectra also enable the sign of the bromine quadrupole coupling constant to be confirmed as positive.
    Additional Material: 2 Ill.
    Type of Medium: Electronic Resource
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