Information card for entry 4503208

Structure parameters

• Formula: C14 H13 N2 O7 Zn
• Calculated formula: C14 H13 N2 O7 Zn
• Title of publication: Hydrothermal Synthesis of Metal−Organic Frameworks Based on Aromatic Polycarboxylate and Flexible Bis(imidazole) Ligands
• Authors of publication: Qi, Yan; Luo, Feng; Che, Yunxia; Zheng, Jimin
• Journal of publication: Crystal Growth & Design
• Year of publication: 2008
• Journal volume: 8
• Journal issue: 2
• Pages of publication: 606
• a: 8.7582 ± 0.0018 Å
• b: 8.8731 ± 0.0018 Å
• c: 10.21 ± 0.002 Å
• α: 95.59 ± 0.03°
• β: 100.37 ± 0.03°
• γ: 102.6 ± 0.03°
• Cell volume: 753.9 ± 0.3 ų
• Cell temperature: 298 ± 2 K
• Ambient diffraction temperature: 298 ± 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: 0.029
• Residual factor for significantly intense reflections: 0.0271
• Weighted residual factors for significantly intense reflections: 0.0788
• Weighted residual factors for all reflections included in the refinement: 0.0799
• Goodness-of-fit parameter for all reflections included in the refinement: 1.105
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No