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Experimental and theoretical study of the structures and enthalpies of formation of 3H-1,3-benzoxazole-2-thione, 3H-1,3-benzothiazole-2-thione, and their tautomers.
Journal of Physical Chemistry A (2010)
  • Maria Victoria Roux, Spanish National Research Council
  • Manuel Temprado, Spanish National Research Council
  • Pilar Jiménez, Spanish National Research Council
  • Concepción Foces-Foces, Spanish National Research Council
  • Rafael Notario, Spanish National Research Council
  • Archana R. Parameswar, University of Missouri–St. Louis
  • Alexei V. Demchenko, University of Missouri–St. Louis
  • James S. Chickos, University of Missouri–St. Louis
  • Carol A. Deakyne, University of Missouri
  • Joel F. Liebman, University of Maryland, College Park
Disciplines
Publication Date
June 3, 2010
DOI
10.1021/jp102126j
Citation Information
Maria Victoria Roux, Manuel Temprado, Pilar Jiménez, Concepción Foces-Foces, et al.. "Experimental and theoretical study of the structures and enthalpies of formation of 3H-1,3-benzoxazole-2-thione, 3H-1,3-benzothiazole-2-thione, and their tautomers." Journal of Physical Chemistry A Vol. 114 Iss. 21 (2010) p. 6336 - 6341
Available at: http://works.bepress.com/alexei-demchenko/70/