Information card for entry 8102576

Structure parameters

• Formula: C16 H18 N8 Ni O8 S2
• Calculated formula: C16 H18 N8 Ni O8 S2
• Title of publication: Crystal structure of bis[1-(2-hydroxybenzylidene)thiosemicarbazido]nickel(II) dinitrate, [Ni(C8H9N3OS)2](NO3)2
• Authors of publication: Yu-Ting Wang; Hui-Ling Li; Jian-Ge Wang
• Journal of publication: Zeitschrift für Kristallographie - New Crystal Structures
• Year of publication: 2010
• Journal volume: 225
• Journal issue: 1
• Pages of publication: 79
• a: 17.964 ± 0.002 Å
• b: 9.8343 ± 0.0011 Å
• c: 14.1222 ± 0.0016 Å
• α: 90°
• β: 110.582 ± 0.001°
• γ: 90°
• Cell volume: 2335.6 ± 0.5 ų
• Cell temperature: 296 ± 2 K
• Ambient diffraction temperature: 296 ± 2 K
• Number of distinct elements: 6
• Space group number: 15
• Hermann-Mauguin space group symbol: C 1 2/c 1
• Hall space group symbol: -C 2yc
• Residual factor for all reflections: 0.0337
• Residual factor for significantly intense reflections: 0.0275
• Weighted residual factors for significantly intense reflections: 0.066
• Weighted residual factors for all reflections included in the refinement: 0.0701
• Goodness-of-fit parameter for all reflections included in the refinement: 1.029
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No