Information card for entry 4509988

Structure parameters

• Formula: C21 H18 Co N6 O6 S
• Calculated formula: C21 H18 Co N6 O6 S
• Title of publication: Rational Assembly of Co/Cd-MOFs Featuring Topological Variation
• Authors of publication: Wang, Hao; Yi, Fei-Yan; Dang, Song; Tian, Wan-Guo; Sun, Zhong-Ming
• Journal of publication: Crystal Growth & Design
• Year of publication: 2014
• Journal volume: 14
• Journal issue: 1
• Pages of publication: 147
• a: 18.296 ± 0.002 Å
• b: 9.8044 ± 0.0011 Å
• c: 13.0202 ± 0.0015 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 2335.6 ± 0.5 ų
• Cell temperature: 273 ± 2 K
• Ambient diffraction temperature: 273 ± 2 K
• Number of distinct elements: 6
• Space group number: 29
• Hermann-Mauguin space group symbol: P c a 21
• Hall space group symbol: P 2c -2ac
• Residual factor for all reflections: 0.0582
• Residual factor for significantly intense reflections: 0.0422
• Weighted residual factors for significantly intense reflections: 0.0976
• Weighted residual factors for all reflections included in the refinement: 0.1061
• Goodness-of-fit parameter for all reflections included in the refinement: 0.992
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No