Information card for entry 2218512

Structure parameters

• Chemical name: Poly[aqua[μ~3~-5-(2-carboxylatophenyl)-1<i>H</i>-tetrazolato]zinc(II)]
• Formula: C8 H6 N4 O3 Zn
• Calculated formula: C8 H6 N4 O3 Zn
• Title of publication: Poly[aqua[μ~3~-5-(2-carboxylatophenyl)-1<i>H</i>-tetrazolato]zinc(II)]
• Authors of publication: Li, Xiu-Zhi; Qu, Zhi-Rong
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2008
• Journal volume: 64
• Journal issue: 6
• Pages of publication: m808
• a: 19.696 ± 0.008 Å
• b: 7.134 ± 0.0018 Å
• c: 14.932 ± 0.006 Å
• α: 90°
• β: 114.39 ± 0.02°
• γ: 90°
• Cell volume: 1910.9 ± 1.2 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 5
• 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: 0.0757
• Residual factor for significantly intense reflections: 0.0495
• Weighted residual factors for significantly intense reflections: 0.1013
• Weighted residual factors for all reflections included in the refinement: 0.1119
• Goodness-of-fit parameter for all reflections included in the refinement: 1.077
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes