Information card for entry 7108466

Structure parameters

• Formula: C84 H79 Co3 N8 O27
• Calculated formula: C84 H58 Co3 N8 O27
• Title of publication: Chiral transformations of achiral porous metal-organic frameworks via a stepwise approach
• Authors of publication: Fei-Yan Yi; Jian Zhang; Hai-Xia Zhang; Zhong-Ming Sun
• Journal of publication: Chem.Commun.
• Year of publication: 2012
• Journal volume: 48
• Pages of publication: 10419
• a: 24.728 ± 0.003 Å
• b: 10.9381 ± 0.0013 Å
• c: 34.326 ± 0.004 Å
• α: 90°
• β: 99.917 ± 0.002°
• γ: 90°
• Cell volume: 9145.7 ± 1.9 ų
• Cell temperature: 273 ± 2 K
• Ambient diffraction temperature: 273 ± 2 K
• Number of distinct elements: 5
• Space group number: 15
• Hermann-Mauguin space group symbol: C 1 2/c 1
• Hall space group symbol: -C 2yc
• Residual factor for all reflections: 0.1022
• Residual factor for significantly intense reflections: 0.0635
• Weighted residual factors for significantly intense reflections: 0.179
• Weighted residual factors for all reflections included in the refinement: 0.2074
• Goodness-of-fit parameter for all reflections included in the refinement: 1.003
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No