Information card for entry 7230182

Structure parameters

• Formula: C14 H8 N5 O5 Zn2
• Calculated formula: C14 H8 N5 O5 Zn2
• Title of publication: Six novel coordination polymers based on the 5-(1H-tetrazol-5-yl)isophthalic acid ligand: structures, luminescence, and magnetic properties
• Authors of publication: Zhang, Xiu-Mei; Liu, Feng; Gao, Wei; Huang, Hong; Liu, Jie-Ping
• Journal of publication: CrystEngComm
• Year of publication: 2018
• Journal volume: 20
• Journal issue: 14
• Pages of publication: 1985
• a: 7.9093 ± 0.0014 Å
• b: 8.4758 ± 0.0014 Å
• c: 11.879 ± 0.002 Å
• α: 105.314 ± 0.005°
• β: 105.849 ± 0.006°
• γ: 94.385 ± 0.006°
• Cell volume: 729.3 ± 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: 0.0329
• Residual factor for significantly intense reflections: 0.0267
• Weighted residual factors for significantly intense reflections: 0.0634
• Weighted residual factors for all reflections included in the refinement: 0.0662
• Goodness-of-fit parameter for all reflections included in the refinement: 1.056
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No