Information card for entry 7216006

Structure parameters

• Formula: C40 H38 Co N4 O10
• Calculated formula: C40 H38 Co N4 O10
• Title of publication: Four new metal‒organic frameworks based on a rigid linear ligand: synthesis, optical properties and structural investigation
• Authors of publication: Zhang, Chuanlei; Hao, Han; Shi, Zhenzhen; Zheng, Hegen
• Journal of publication: CrystEngComm
• Year of publication: 2014
• a: 22.625 ± 0.002 Å
• b: 14.9276 ± 0.0013 Å
• c: 30.645 ± 0.002 Å
• α: 90°
• β: 128.963 ± 0.004°
• γ: 90°
• Cell volume: 8047.6 ± 1.2 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: 0.1328
• Residual factor for significantly intense reflections: 0.0644
• Weighted residual factors for significantly intense reflections: 0.1449
• Weighted residual factors for all reflections included in the refinement: 0.1639
• Goodness-of-fit parameter for all reflections included in the refinement: 1.011
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No