Information card for entry 7021967

Structure parameters

• Formula: C48 H40 Cd4 N8 O21
• Calculated formula: C48 H40 Cd4 N8 O21
• Title of publication: Syntheses, crystal structures and thermal properties of six coordination polymers based on 2-(p-methylphenyl)-imidazole dicarboxylate.
• Authors of publication: Zhang, Yu; Yuan, Pengfei; Zhu, Yanyan; Li, Gang
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2013
• Journal volume: 42
• Journal issue: 41
• Pages of publication: 14776 - 14785
• a: 22.29 ± 0.003 Å
• b: 22.29 ± 0.003 Å
• c: 15.123 ± 0.003 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 7514 ± 2 ų
• Cell temperature: 296 ± 2 K
• Ambient diffraction temperature: 296 ± 2 K
• Number of distinct elements: 5
• Space group number: 88
• Hermann-Mauguin space group symbol: I 41/a :2
• Hall space group symbol: -I 4ad
• Residual factor for all reflections: 0.1787
• Residual factor for significantly intense reflections: 0.0892
• Weighted residual factors for significantly intense reflections: 0.2526
• Weighted residual factors for all reflections included in the refinement: 0.2929
• Goodness-of-fit parameter for all reflections included in the refinement: 0.936
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No