Information card for entry 4134750

Structure parameters

• Formula: C312 H210 Co6 F72 N72 O48 S24
• Calculated formula: C296 H210 Co6 F24 N64 O16 S8
• Title of publication: Narcissistic, Integrative, and Kinetic Self-Sorting within a System of Coordination Cages.
• Authors of publication: Rizzuto, Felix J.; Nitschke, Jonathan R.
• Journal of publication: Journal of the American Chemical Society
• Year of publication: 2020
• Journal volume: 142
• Journal issue: 17
• Pages of publication: 7749 - 7753
• a: 26.428 ± 0.005 Å
• b: 34.545 ± 0.007 Å
• c: 48.902 ± 0.01 Å
• α: 79.82 ± 0.03°
• β: 85.36 ± 0.03°
• γ: 78.09 ± 0.03°
• Cell volume: 42951 ± 16 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 7
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.2107
• Residual factor for significantly intense reflections: 0.1698
• Weighted residual factors for significantly intense reflections: 0.3991
• Weighted residual factors for all reflections included in the refinement: 0.4249
• Goodness-of-fit parameter for all reflections included in the refinement: 1.089
• Diffraction radiation wavelength: 0.6889 Å
• Diffraction radiation type: Synchrotron
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No