Information card for entry 7212244

Structure parameters

• Formula: C12 H12 N8 Ni O3
• Calculated formula: C12 H12 N8 Ni O3
• Title of publication: Canted antiferromagnetic behaviours in isostructural Co(ii) and Ni(ii) frameworks with helical lvt topology
• Authors of publication: Lin, Qi-Pu; Zhang, Jian; Cao, Xin-Yi; Yao, Yuan-Gen; Li, Zhao-Ji; Zhang, Lei; Zhou, Zhang-Feng
• Journal of publication: CrystEngComm
• Year of publication: 2010
• Journal volume: 12
• Journal issue: 10
• Pages of publication: 2938
• a: 15.547 ± 0.001 Å
• b: 15.547 ± 0.001 Å
• c: 12.4988 ± 0.0013 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 3021.1 ± 0.4 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 5
• Space group number: 88
• Hermann-Mauguin space group symbol: I 41/a :2
• Hall space group symbol: -I 4ad
• Residual factor for all reflections: 0.0416
• Residual factor for significantly intense reflections: 0.0392
• Weighted residual factors for significantly intense reflections: 0.0979
• Weighted residual factors for all reflections included in the refinement: 0.1
• Goodness-of-fit parameter for all reflections included in the refinement: 1.007
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No