Information card for entry 4501511

Structure parameters

• Formula: C17 H22.5 Co N8 O5.25 S
• Calculated formula: C17 H22.5 Co N8 O5.25 S
• Title of publication: Eight Two-Dimensional and Three-Dimensional Metal−Organic Frameworks Based on a Flexible Tetrakis(imidazole) Ligand: Synthesis, Topological Structures, and Photoluminescent Properties
• Authors of publication: Bai, Hong-Ye; Ma, Jian-Fang; Yang, Jin; Zhang, Lai-Ping; Ma, Ji-Cheng; Liu, Ying-Ying
• Journal of publication: Crystal Growth & Design
• Year of publication: 2010
• Journal volume: 10
• Journal issue: 4
• Pages of publication: 1946
• a: 9.615 ± 0.002 Å
• b: 18.555 ± 0.003 Å
• c: 11.988 ± 0.003 Å
• α: 90°
• β: 108.24 ± 0.02°
• γ: 90°
• Cell volume: 2031.3 ± 0.8 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 6
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/n 1
• Hall space group symbol: -P 2yn
• Residual factor for all reflections: 0.0611
• Residual factor for significantly intense reflections: 0.0391
• Weighted residual factors for significantly intense reflections: 0.089
• Weighted residual factors for all reflections included in the refinement: 0.0951
• Goodness-of-fit parameter for all reflections included in the refinement: 0.938
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No