articleJournal of the American Chemical SocietyOct 6, 2017GREEN OA

The Origin of Chalcogen-Bonding Interactions

University of Edinburgh · Syngenta (United Kingdom) · +1 more institution

PubMed
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Abstract

Favorable molecular interactions between group 16 elements have been implicated in catalysis, biological processes, and materials and medicinal chemistry. Such interactions have since become known as chalcogen bonds by analogy to hydrogen and halogen bonds. Although the prevalence and applications of chalcogen-bonding interactions continues to develop, debate still surrounds the energetic significance and physicochemical origins of this class of σ-hole interaction. Here, synthetic molecular balances were used to perform a quantitative experimental investigation of chalcogen-bonding interactions. Over 160 experimental conformational free energies were measured in 13 different solvents to examine the energetics…

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527
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Authors

3

Topics & keywords

Keywords
  • Chalcogen
  • Chemistry
  • Antibonding molecular orbital
  • Lone pair
  • Hydrogen bond
  • Computational chemistry
  • Crystallography
  • Natural bond orbital
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