Information card for entry 7108224

Structure parameters

• Formula: C150 Co5 N10 O41 Zn4
• Calculated formula: C150 Co5 N10 O41 Zn4
• Title of publication: Blocking bimolecular activation pathways leads to different regioselectivity in metal-organic framework catalysis
• Authors of publication: Teng Zhang; Feijie Song; Wenbin Lin
• Journal of publication: Chem.Commun.
• Year of publication: 2012
• Journal volume: 48
• Pages of publication: 8766
• a: 17.9269 ± 0.0009 Å
• b: 19.2699 ± 0.001 Å
• c: 50.45 ± 0.003 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 17427.9 ± 1.6 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 5
• Space group number: 23
• Hermann-Mauguin space group symbol: I 2 2 2
• Hall space group symbol: I 2 2
• Residual factor for all reflections: 0.1027
• Residual factor for significantly intense reflections: 0.0839
• Weighted residual factors for significantly intense reflections: 0.2247
• Weighted residual factors for all reflections included in the refinement: 0.2389
• Goodness-of-fit parameter for all reflections included in the refinement: 1.451
• Diffraction radiation wavelength: 1.54178 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No