Information card for entry 7221696

Structure parameters

• Formula: C46 H56 Co5 N8 O30 P2
• Calculated formula: C46 H56 Co5 N8 O30 P2
• Title of publication: Modulating the microporosity of cobalt phosphonates via positional isomerism of co-linkers
• Authors of publication: Zheng, Tao; Cai, Zhong-Sheng; Nie, Wei-Xuan; Ren, Min; Bao, Song-Song; Zheng, Li-Min
• Journal of publication: CrystEngComm
• Year of publication: 2015
• Journal volume: 17
• Journal issue: 46
• Pages of publication: 8926
• a: 9.2565 ± 0.0014 Å
• b: 10.1736 ± 0.0015 Å
• c: 15.405 ± 0.002 Å
• α: 95.282 ± 0.003°
• β: 105.188 ± 0.002°
• γ: 91.394 ± 0.002°
• Cell volume: 1392.3 ± 0.3 ų
• Cell temperature: 173 ± 2 K
• Ambient diffraction temperature: 173 ± 2 K
• Number of distinct elements: 6
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0443
• Residual factor for significantly intense reflections: 0.0327
• Weighted residual factors for significantly intense reflections: 0.0791
• Weighted residual factors for all reflections included in the refinement: 0.0829
• Goodness-of-fit parameter for all reflections included in the refinement: 1.002
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No