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  • Molecular modeling  (1)
  • 1995-1999  (1)
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  • 1995-1999  (1)
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    Electronic Resource
    Electronic Resource
    Weinheim : Wiley-Blackwell
    Electroanalysis 9 (1997), S. 1054-1061 
    ISSN: 1040-0397
    Keywords: Surface acoustic wave sensor ; Silanization ; Molecular modeling ; Chemistry ; Polymer and Materials Science
    Source: Wiley InterScience Backfile Collection 1832-2000
    Topics: Chemistry and Pharmacology
    Notes: A film containing vicinal diol groups has been formed on the quartz surface of a surface acoustic wave sensor through a silanization reaction with 3-glycidoxypropyltrimethoxysilane. The interactive selectivity of the silane surface for adsorption of several vapor analytes was measured using a gas chromatograph-acoustic wave device combination. Much larger responses are obtained for compounds containing a nitrofunctional group. Computational chemistry is employed to calculate interaction energies for purported hydrogen-bond complexes between analyte molecules and ethylene glycol, an analogue of the surface silane species. The results of these calculations are compared to the experimental sensor responses.
    Additional Material: 5 Ill.
    Type of Medium: Electronic Resource
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