Information card for entry 1564077

Structure parameters

• Formula: C12 H8 N6 O5 Zn
• Calculated formula: C12 H8 N6 O5 Zn
• Title of publication: New three-dimensional Zn(II)/Cd(II)-based coordination polymers as luminescent sensor for Cu2+
• Authors of publication: Cai, Hua; Li, Na; Li, Yan; An, Dong-Ming
• Journal of publication: Inorganica Chimica Acta
• Year of publication: 2020
• Journal volume: 512
• Pages of publication: 119886
• a: 19.229 ± 0.007 Å
• b: 10.703 ± 0.003 Å
• c: 14.694 ± 0.004 Å
• α: 90°
• β: 120.159 ± 0.004°
• γ: 90°
• Cell volume: 2614.8 ± 1.4 ų
• Cell temperature: 296 ± 2 K
• Ambient diffraction temperature: 296 ± 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: 0.0551
• Residual factor for significantly intense reflections: 0.0356
• Weighted residual factors for significantly intense reflections: 0.0709
• Weighted residual factors for all reflections included in the refinement: 0.0779
• Goodness-of-fit parameter for all reflections included in the refinement: 1.004
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No