Information card for entry 2237793

Structure parameters

• Chemical name: 1,5-Bis[1-(4-bromophenyl)ethylidene]thiocarbonohydrazide
• Formula: C17 H16 Br2 N4 S
• Calculated formula: C17 H16 Br2 N4 S
• SMILES: S=C(N/N=C(/c1ccc(cc1)Br)C)N/N=C(/c1ccc(cc1)Br)C
• Title of publication: 1,5-Bis[1-(4-bromophenyl)ethylidene]thiocarbonohydrazide
• Authors of publication: Gao, Zhiqing
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2013
• Journal volume: 69
• Journal issue: 5
• Pages of publication: o723
• a: 11.58 ± 0.0011 Å
• b: 13.695 ± 0.0012 Å
• c: 14.286 ± 0.0013 Å
• α: 118.401 ± 0.002°
• β: 90.977 ± 0.001°
• γ: 108.404 ± 0.001°
• Cell volume: 1852.6 ± 0.3 ų
• Cell temperature: 298 ± 2 K
• Ambient diffraction temperature: 298 ± 2 K
• Number of distinct elements: 5
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.1723
• Residual factor for significantly intense reflections: 0.0725
• Weighted residual factors for significantly intense reflections: 0.1666
• Weighted residual factors for all reflections included in the refinement: 0.2141
• Goodness-of-fit parameter for all reflections included in the refinement: 0.955
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes