Information card for entry 4001278

Structure parameters

• Common name: TIF-5Co
• Chemical name: TIF-5Co
• Formula: C12 H18 Co N4 O3
• Calculated formula: C12 H12 Co N4 O
• Title of publication: New Zeolitic Imidazolate Frameworks: From Unprecedented Assembly of Cubic Clusters to Ordered Cooperative Organization of Complementary Ligands
• Authors of publication: Wu, Tao; Bu, Xianhui; Zhang, Jian; Feng, Pingyun
• Journal of publication: Chemistry of Materials
• Year of publication: 2008
• Journal volume: 20
• Journal issue: 24
• Pages of publication: 7377
• a: 16.6286 ± 0.0002 Å
• b: 16.6286 ± 0.0002 Å
• c: 21.4148 ± 0.0004 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 5921.41 ± 0.15 ų
• Cell temperature: 150 ± 2 K
• Ambient diffraction temperature: 150 ± 2 K
• Number of distinct elements: 5
• Space group number: 88
• Hermann-Mauguin space group symbol: I 41/a :2
• Hall space group symbol: -I 4ad
• Residual factor for all reflections: 0.0896
• Residual factor for significantly intense reflections: 0.0652
• Weighted residual factors for significantly intense reflections: 0.1927
• Weighted residual factors for all reflections included in the refinement: 0.2156
• Goodness-of-fit parameter for all reflections included in the refinement: 1.077
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No