Information card for entry 7038895

Structure parameters

• Formula: C6 H8 N8 Ni O3
• Calculated formula: C6 H6 N8 Ni O3
• Title of publication: Composition dependence of magnetic relaxation for CoNi chain-based compounds with mixed double azide-tetrazolate bridges.
• Authors of publication: Cheng, Min; Ding, You-Song; Gao, En-Qing; Zhang, Zhicheng; Jia, Qin-Xiang
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2016
• Journal volume: 45
• Journal issue: 19
• Pages of publication: 8028 - 8035
• a: 8.139 ± 0.01 Å
• b: 7.312 ± 0.008 Å
• c: 17.88 ± 0.02 Å
• α: 90°
• β: 100.647 ± 0.014°
• γ: 90°
• Cell volume: 1046 ± 2 ų
• Cell temperature: 296 ± 2 K
• Ambient diffraction temperature: 296 ± 2 K
• Number of distinct elements: 5
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/c 1
• Hall space group symbol: -P 2ybc
• Residual factor for all reflections: 0.0806
• Residual factor for significantly intense reflections: 0.0606
• Weighted residual factors for significantly intense reflections: 0.1588
• Weighted residual factors for all reflections included in the refinement: 0.1696
• Goodness-of-fit parameter for all reflections included in the refinement: 1.112
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No