Information card for entry 2016957

Structure parameters

• Chemical name: poly[[μ~2~-1,4-bis(imidazol-1-yl)benzene](μ~2~-terephthalato)dizinc(II)]
• Formula: C14 H9 N2 O4 Zn
• Calculated formula: C14 H9 N2 O4 Zn
• Title of publication: A novel threefold-interpenetrating primitive cubic network based on a dinuclear Zn~2~ node
• Authors of publication: Diao, Yun-Peng; Li, Kun; Huang, Shan-Shan; Shu, Xiao-Hong; Liu, Ke-Xin; Deng, Xu-Ming
• Journal of publication: Acta Crystallographica Section C
• Year of publication: 2009
• Journal volume: 65
• Journal issue: 2
• Pages of publication: m82 - m85
• a: 6.9711 ± 0.0014 Å
• b: 8.0784 ± 0.0016 Å
• c: 11.903 ± 0.002 Å
• α: 102.68 ± 0.03°
• β: 99.68 ± 0.03°
• γ: 96.32 ± 0.03°
• Cell volume: 637.1 ± 0.2 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 5
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0533
• Residual factor for significantly intense reflections: 0.0431
• Weighted residual factors for significantly intense reflections: 0.0984
• Weighted residual factors for all reflections included in the refinement: 0.1032
• Goodness-of-fit parameter for all reflections included in the refinement: 1.106
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes