Information card for entry 7129865

Structure parameters

• Formula: C52 H72 Co4 N8 S4
• Calculated formula: C52 H72 Co4 N8 S4
• Title of publication: Synthesis and Disassembly of an Organometallic Polymer Comprising Redox-active Co4S4 Clusters and Janus Biscarbene Linkers
• Authors of publication: Gillen , Jonathan; Moore, Connor; Vuong, My; Shajahan, Juvairia; Anstey, Mitchell Ryan; Alston, Jeffrey R.; Bejger, Christopher Michael
• Journal of publication: Chemical Communications
• Year of publication: 2022
• a: 12.9073 ± 0.0005 Å
• b: 13.2862 ± 0.0005 Å
• c: 17.5673 ± 0.0006 Å
• α: 94.342 ± 0.003°
• β: 95.063 ± 0.003°
• γ: 93.514 ± 0.003°
• Cell volume: 2985.22 ± 0.19 ų
• Cell temperature: 100 ± 0.1 K
• Ambient diffraction temperature: 100 ± 0.1 K
• Number of distinct elements: 5
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0695
• Residual factor for significantly intense reflections: 0.0416
• Weighted residual factors for significantly intense reflections: 0.0813
• Weighted residual factors for all reflections included in the refinement: 0.0958
• Goodness-of-fit parameter for all reflections included in the refinement: 1.028
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No