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SWAIN CHEMISTRY AND CHEMICAL ENGINEERING LIBRARY
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Chemical Abstracts

SciFinder Scholar | CAS Online | Standard Abbreviations | Index Guide | Guide to CASREACT | Structure Searching with STN Express

Structure searching in CAS Online using STN Express: An introductory workshop

Building structures: System defaults

  • Build the basic structure
  • What you draw is what you get
  • Need to override system defaults so that what you see is what you want
  • Block substitution to get more specific structures
    • Add hydrogens
    • Specify bond values
    • Use refinement filters
  • Increase variability to get more generic structures
    • System-defined variables
    • Variable point of attachment
    • G-groups
    • Bonds


Last modified: June 22, 2005

   
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