Information card for entry 7044354

Structure parameters

• Formula: H16 N10 O8 Zn
• Calculated formula: H16 N10 O8 Zn
• Title of publication: A Carbon-free Inorganic-metal Complex Consisting of All-nitrogen Pentazole Anion, Zn(II) Cation and H2O
• Authors of publication: Xu, Yuangang; Wang, Pengcheng; Lin, Qiuhan; Lu, Ming
• Journal of publication: Dalton Trans.
• Year of publication: 2017
• a: 12.293 ± 0.004 Å
• b: 17.319 ± 0.006 Å
• c: 6.536 ± 0.002 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 1391.5 ± 0.8 ų
• Cell temperature: 205 K
• Ambient diffraction temperature: 205 K
• Number of distinct elements: 4
• Space group number: 69
• Hermann-Mauguin space group symbol: F m m m
• Hall space group symbol: -F 2 2
• Residual factor for all reflections: 0.0303
• Residual factor for significantly intense reflections: 0.0302
• Weighted residual factors for significantly intense reflections: 0.0707
• Weighted residual factors for all reflections included in the refinement: 0.0707
• Goodness-of-fit parameter for all reflections included in the refinement: 1.198
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No