Information card for entry 1515048

Structure parameters

• Formula: C348 H354 Cl6 Co24 N6 O72 S24
• Calculated formula: C336 H312 Cl6 Co24 O72 S24
• Title of publication: Truncated octahedral coordination cage incorporating six tetranuclear-metal building blocks and twelve linear edges
• Authors of publication: Xiong, Kecai; Jiang, Feilong; Gai, Yanli; Yuan, Daqiang; Chen, Lian; Wu, Mingyan; Su, Kongzhao; Hong, Maochun
• Journal of publication: Chemical Science
• Year of publication: 2012
• Journal volume: 3
• Journal issue: 7
• Pages of publication: 2321
• a: 48.8463 ± 0.0007 Å
• b: 48.8463 ± 0.0007 Å
• c: 48.8463 ± 0.0007 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 116545 ± 3 ų
• Cell temperature: 123 ± 2 K
• Ambient diffraction temperature: 123 ± 2 K
• Number of distinct elements: 7
• Space group number: 206
• Hermann-Mauguin space group symbol: I a -3
• Hall space group symbol: -I 2b 2c 3
• Residual factor for all reflections: 0.1172
• Residual factor for significantly intense reflections: 0.092
• Weighted residual factors for significantly intense reflections: 0.2329
• Weighted residual factors for all reflections included in the refinement: 0.2494
• Goodness-of-fit parameter for all reflections included in the refinement: 1.076
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No