Information card for entry 7238907

Structure parameters

• Formula: C20 H33 Br8 Cl2 Co2 N8 O12.5
• Calculated formula: C20 H33 Br8 Cl2 Co2 N8 O12.5
• Title of publication: A series of tetrabromocatecholate chelated cobalt(iii) complexes with various N-donor ancillary ligands: syntheses, crystal structures, co-crystallization, thermally induced valence tautomerism and electrochemical studies
• Authors of publication: Panja, Anangamohan
• Journal of publication: RSC Advances
• Year of publication: 2013
• Journal volume: 3
• Journal issue: 15
• Pages of publication: 4954
• a: 15.5601 ± 0.0006 Å
• b: 28.2409 ± 0.001 Å
• c: 8.9927 ± 0.0003 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 3951.7 ± 0.2 ų
• Cell temperature: 298 ± 2 K
• Ambient diffraction temperature: 298 ± 2 K
• Number of distinct elements: 7
• Space group number: 18
• Hermann-Mauguin space group symbol: P 21 21 2
• Hall space group symbol: P 2 2ab
• Residual factor for all reflections: 0.0795
• Residual factor for significantly intense reflections: 0.0652
• Weighted residual factors for significantly intense reflections: 0.1518
• Weighted residual factors for all reflections included in the refinement: 0.1585
• Goodness-of-fit parameter for all reflections included in the refinement: 1.093
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No