Information card for entry 7220929

Structure parameters

• Formula: C24 H16 N4 O4 Zn
• Calculated formula: C24 H16 N4 O4 Zn
• Title of publication: Fabrication of porous metal‒organic frameworks via a mixed-ligand strategy for highly selective and efficient dye adsorption in aqueous solution
• Authors of publication: Zhang, Xueqiong; Gao, Yanfei; Liu, Houting; Liu, Zhiliang
• Journal of publication: CrystEngComm
• Year of publication: 2015
• Journal volume: 17
• Journal issue: 31
• Pages of publication: 6037
• a: 19.499 ± 0.003 Å
• b: 19.499 ± 0.003 Å
• c: 10.738 ± 0.002 Å
• α: 90°
• β: 90°
• γ: 120°
• Cell volume: 3535.7 ± 1 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 5
• Space group number: 147
• Hermann-Mauguin space group symbol: P -3
• Hall space group symbol: -P 3
• Residual factor for all reflections: 0.148
• Residual factor for significantly intense reflections: 0.1078
• Weighted residual factors for significantly intense reflections: 0.305
• Weighted residual factors for all reflections included in the refinement: 0.3403
• Goodness-of-fit parameter for all reflections included in the refinement: 1.165
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No