Počet záznamů: 1

Br • • •O Complexes as Probes of Factors Affecting Halogen Bonding: Interactions of Bromobenzenes and Bromopyrimidines with Acetone

  1. 1.
    0327916 - UOCHB-X 2010 RIV US eng J - Článek v odborném periodiku
    Riley, Kevin Eugene - Murray, J. S. - Politzer, P. - Concha, M. C. - Hobza, Pavel
    Br • • •O Complexes as Probes of Factors Affecting Halogen Bonding: Interactions of Bromobenzenes and Bromopyrimidines with Acetone.
    Journal of Chemical Theory and Computation. Roč. 5, č. 1 (2009), s. 155-163 ISSN 1549-9618
    Grant CEP: GA MŠk LC512
    Grant ostatní: NSF EPSCOR(US) EPS0701525
    Výzkumný záměr: CEZ:AV0Z40550506
    Klíčová slova: halogen bonding * ab initio calculations
    Kód oboru RIV: CF - Fyzikální chemie a teoretická chemie
    Impakt faktor: 4.804, rok: 2009

    Halogen bonding is a unique type of noncovalent binding phenomenon in which a halogen atom interacts attractively with an electronegative atom such as oxygen or nitrogen. These types of interactions have been the subject of many recent investigations because of their potential in the development of new materials and pharmaceutical compounds. Recently, it was observed that most halogen bonding interactions in biological contexts involve close contacts between a halogen bound to an aromatic ring and a carbonyl oxygen on a protein’s backbone structure.
    Trvalý link: http://hdl.handle.net/11104/0174352