Information card for entry 4305833

Structure parameters

• Formula: C21 H23 Co N3 O6
• Calculated formula: C21 H23 Co N3 O6
• Title of publication: Two- and Three-fold Interpenetrated Metal-Organic Frameworks from One-Pot Crystallization
• Authors of publication: Mohammad Hedayetullah Mir; Susumu Kitagawa; Jagadese J. Vittal
• Journal of publication: Inorganic Chemistry
• Year of publication: 2008
• Journal volume: 47
• Pages of publication: 7728 - 7733
• a: 13.717 ± 0.0006 Å
• b: 14.7878 ± 0.0006 Å
• c: 21.0282 ± 0.0008 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 4265.4 ± 0.3 ų
• Cell temperature: 223 ± 2 K
• Ambient diffraction temperature: 223 ± 2 K
• Number of distinct elements: 5
• Space group number: 61
• Hermann-Mauguin space group symbol: P b c a
• Hall space group symbol: -P 2ac 2ab
• Residual factor for all reflections: 0.0881
• Residual factor for significantly intense reflections: 0.0595
• Weighted residual factors for significantly intense reflections: 0.1533
• Weighted residual factors for all reflections included in the refinement: 0.1688
• Goodness-of-fit parameter for all reflections included in the refinement: 1.027
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No