Information card for entry 7224072

Structure parameters

• Common name: {Co16 Cl4 [C40H44S4O4]4 [C13H7NO4]8}
• Formula: C264 H232 Cl4 Co16 N8 O48 S16
• Calculated formula: C264 H56 Cl4 Co16 N8 O48 S16
• Title of publication: pH-dependent formation of different coordination cages based on Co4-TC4A secondary building units and bridging ligands
• Authors of publication: Hang, Xinxin; Wang, Shentang; Zhu, Xiaofei; Han, Haitao; Liao, Wuping
• Journal of publication: CrystEngComm
• Year of publication: 2016
• Journal volume: 18
• Journal issue: 26
• Pages of publication: 4938
• a: 30.163 ± 0.0003 Å
• b: 30.163 ± 0.0003 Å
• c: 21.6122 ± 0.0004 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 19662.9 ± 0.5 ų
• Cell temperature: 150 ± 2 K
• Ambient diffraction temperature: 150 ± 2 K
• Number of distinct elements: 7
• Space group number: 87
• Hermann-Mauguin space group symbol: I 4/m
• Hall space group symbol: -I 4
• Residual factor for all reflections: 0.1157
• Residual factor for significantly intense reflections: 0.1102
• Weighted residual factors for significantly intense reflections: 0.3034
• Weighted residual factors for all reflections included in the refinement: 0.311
• Goodness-of-fit parameter for all reflections included in the refinement: 1.111
• Diffraction radiation wavelength: 1.54178 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No