Information card for entry 7214978

Structure parameters

• Formula: C40 H32 Cd N4 O8
• Calculated formula: C40 H32 Cd N4 O8
• Title of publication: Construction of a series of metal‒organic frameworks with a neutral tetradentate ligand and rigid carboxylate co-ligands
• Authors of publication: Qin, Ling; Hu, Jin-Song; Zhang, Ming-Dao; Li, Yi-Zhi; Zheng, He-Gen
• Journal of publication: CrystEngComm
• Year of publication: 2012
• Journal volume: 14
• Journal issue: 23
• Pages of publication: 8274
• a: 14.2461 ± 0.0016 Å
• b: 21.754 ± 0.003 Å
• c: 11.6482 ± 0.0013 Å
• α: 90°
• β: 95.942 ± 0.002°
• γ: 90°
• Cell volume: 3590.5 ± 0.8 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: 0.0529
• Residual factor for significantly intense reflections: 0.0479
• Weighted residual factors for significantly intense reflections: 0.1385
• Weighted residual factors for all reflections included in the refinement: 0.1428
• Goodness-of-fit parameter for all reflections included in the refinement: 1.087
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No