Information card for entry 7043318

Structure parameters

• Formula: C78 H52 Cd3 N8 O13
• Calculated formula: C78 H52 Cd3 N8 O13
• Title of publication: Fluorescent sensing and selective adsorption properties of metal-organic frameworks with mixed tricarboxylate and 1H-imidazol-4-yl-containing ligands
• Authors of publication: Liu, Zhi-Qiang; Zhao, Yue; Wang, Peng; Kang, Yan-Shang; Azam, Mohammad; Al-Resayes, Saud I; Liu, Xaio-Hui; Lu, Qingyi; Sun, Wei-Yin
• Journal of publication: Dalton Trans.
• Year of publication: 2017
• a: 15.562 ± 0.0009 Å
• b: 32.1384 ± 0.0018 Å
• c: 14.8953 ± 0.0008 Å
• α: 90°
• β: 91.912 ± 0.001°
• γ: 90°
• Cell volume: 7445.6 ± 0.7 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 5
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/c 1
• Hall space group symbol: -P 2ybc
• Residual factor for all reflections: 0.042
• Residual factor for significantly intense reflections: 0.0346
• Weighted residual factors for significantly intense reflections: 0.0842
• Weighted residual factors for all reflections included in the refinement: 0.0883
• Goodness-of-fit parameter for all reflections included in the refinement: 1.033
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No