Information card for entry 7206819

Structure parameters

• Formula: C69 H51 Co4 N7 O18
• Calculated formula: C69 H51 Co4 N7 O18
• Title of publication: Multi-functional metal‒organic frameworks based on H4mdip: Crystal structure, photoluminescence, selective ion-exchange and catalysis
• Authors of publication: Xiong, Shunshun; Li, Shujuan; Wang, Sujing; Wang, Zhiyong
• Journal of publication: CrystEngComm
• Year of publication: 2011
• Journal volume: 13
• Journal issue: 24
• Pages of publication: 7236
• a: 19.8876 ± 0.0004 Å
• b: 19.8876 ± 0.0004 Å
• c: 19.1704 ± 0.0006 Å
• α: 90°
• β: 90°
• γ: 120°
• Cell volume: 6566.4 ± 0.3 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 5
• Space group number: 145
• Hermann-Mauguin space group symbol: P 32
• Hall space group symbol: P 32
• Residual factor for all reflections: 0.0883
• Residual factor for significantly intense reflections: 0.0732
• Weighted residual factors for significantly intense reflections: 0.2113
• Weighted residual factors for all reflections included in the refinement: 0.2179
• Goodness-of-fit parameter for all reflections included in the refinement: 1.05
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No