Information card for entry 4513380

Structure parameters

• Formula: C10 H5 N3 O4 Zn
• Calculated formula: C10 H5 N3 O4 Zn
• Title of publication: Solvent-Induced Topological Diversity of Two Zn(II) Metal‒Organic Frameworks and High Sensitivity in Recyclable Detection of Nitrobenzene
• Authors of publication: Chen, Di-Ming; Ma, Xiao-Zhou; Shi, Wei; Cheng, Peng
• Journal of publication: Crystal Growth & Design
• Year of publication: 2015
• Journal volume: 15
• Journal issue: 8
• Pages of publication: 3999
• a: 10.9484 ± 0.0003 Å
• b: 12.106 ± 0.0004 Å
• c: 14.7728 ± 0.0005 Å
• α: 90°
• β: 109.791 ± 0.003°
• γ: 90°
• Cell volume: 1842.35 ± 0.11 ų
• Cell temperature: 127.5 ± 0.14 K
• Ambient diffraction temperature: 127.5 ± 0.14 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: 0.0596
• Residual factor for significantly intense reflections: 0.055
• Weighted residual factors for significantly intense reflections: 0.14
• Weighted residual factors for all reflections included in the refinement: 0.1421
• Goodness-of-fit parameter for all reflections included in the refinement: 1.149
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No