Information card for entry 8104724

Structure parameters

• Formula: C18 H20 Br2 N4 O8 S2
• Calculated formula: C18 H20 Br2 N4 O8 S2
• Title of publication: The crystal structure of 6,6′-((1E,1′E)-hydrazine-1,2-diylidenebis(methaneylylidene)) bis(2-bromo-4-nitrophenol) — dimethylsulfoxide (1/2), C14H8Br2N4O6⋅2(C2H6OS)
• Authors of publication: Ma, Ling; Yang, Ruoqi; Li, Jianqing
• Journal of publication: Zeitschrift für Kristallographie - New Crystal Structures
• Year of publication: 2021
• Journal volume: 236
• Journal issue: 4
• Pages of publication: 823 - 825
• a: 6.1463 ± 0.0012 Å
• b: 8.3637 ± 0.0016 Å
• c: 12.461 ± 0.003 Å
• α: 85.578 ± 0.005°
• β: 85.942 ± 0.005°
• γ: 86.31 ± 0.005°
• Cell volume: 635.9 ± 0.2 ų
• Cell temperature: 296 ± 2 K
• Ambient diffraction temperature: 296 ± 2 K
• Number of distinct elements: 6
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.1261
• Residual factor for significantly intense reflections: 0.0601
• Weighted residual factors for significantly intense reflections: 0.0848
• Weighted residual factors for all reflections included in the refinement: 0.0983
• Goodness-of-fit parameter for all reflections included in the refinement: 1.055
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No