publication . Article . Other literature type . 2009


Michael Bolte; M. Khawar Rauf; Abdur Rauf;
Open Access English
  • Published: 08 Jan 2009 Journal: Acta Crystallographica Section E (issn: 1600-5368, Copyright policy)
  • Publisher: International Union of Crystallography
  • Country: Germany
The structure of the title compound, C14H9Cl3N2OS, is composed of discrete molecules with bond lengths and angles quite typical for thiourea compounds of this class. The plane containing the thiocarbonyl and carbonyl groups subtends dihedral angles of 48.19 (3) and 87.51 (3)° with the planes formed by the 3-chloro and 2,6-dichlorophenyl rings, respectively; the dihedral angle between the two benzene ring planes is 45.32 (3)°. An intramolecular N-H...O hydrogen bond stabilizes the molecular conformation and the molecules form intermolecular N-H...S and N-H...O hydrogen bonds, generating a sheet along the alpha axis. Key indicators: single-crystal X-ray study; T =...
free text keywords: Chemistry, QD1-999, Organic Papers, Urea, chemistry.chemical_compound, Bond length, Thio-, Benzene, Dihedral angle, Crystallography, Hydrogen bond, ddc:540

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