Information card for entry 7210296

Structure parameters

• Formula: C7 H8 O6.5 P Zn
• Calculated formula: C7 H4 O6.5 P Zn
• Title of publication: Controllable preparation and structures of two zinc phosphonocarboxylate frameworks with MER and RHO zeolitic topologies
• Authors of publication: Deng, Mingli; Liu, Xiaofeng; Zheng, Qingshu; Chen, Zhenxia; Fang, Changye; Yue, Bin; He, Heyong
• Journal of publication: CrystEngComm
• Year of publication: 2013
• Journal volume: 15
• Journal issue: 35
• Pages of publication: 7056
• a: 23.986 ± 0.006 Å
• b: 23.986 ± 0.006 Å
• c: 10.481 ± 0.004 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 6030 ± 3 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 5
• Space group number: 126
• Hermann-Mauguin space group symbol: P 4/n n c :2
• Hall space group symbol: -P 4a 2bc
• Residual factor for all reflections: 0.0962
• Residual factor for significantly intense reflections: 0.0866
• Weighted residual factors for significantly intense reflections: 0.2631
• Weighted residual factors for all reflections included in the refinement: 0.274
• Goodness-of-fit parameter for all reflections included in the refinement: 1.017
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No