Information card for entry 7220623

Structure parameters

• Formula: C76 H54 N10 O12 Zn2
• Calculated formula: C76 H54 N10 O12 Zn2
• Title of publication: Syntheses, characterization and properties of nine novel Zn(ii) coordination polymers based on 4,4′-(phenylazanediyl)dibenzoic acid and various N-donor ligands
• Authors of publication: Zhao, Lun; Guo, Huadong; Tang, Dong; Zhang, Min
• Journal of publication: CrystEngComm
• Year of publication: 2015
• Journal volume: 17
• Journal issue: 29
• Pages of publication: 5451
• a: 14.3887 ± 0.0018 Å
• b: 15.538 ± 0.002 Å
• c: 17.003 ± 0.002 Å
• α: 87.718 ± 0.003°
• β: 65.714 ± 0.002°
• γ: 76.845 ± 0.003°
• Cell volume: 3367.9 ± 0.7 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: 0.2109
• Residual factor for significantly intense reflections: 0.0798
• Weighted residual factors for significantly intense reflections: 0.1798
• Weighted residual factors for all reflections included in the refinement: 0.2577
• Goodness-of-fit parameter for all reflections included in the refinement: 0.964
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No