Information card for entry 8106802

Structure parameters

• Formula: C47 H31 Co2 N2 O12
• Calculated formula: C47 H31 Co2 N2 O12
• Title of publication: Crystal structure of poly[bis(μ4-4,4′-(1,2-phenylenebis(oxy))dibenzoato-κ4 O:O′:O′′:O′′′)bis(μ3-4,4′-(1,2-phenylenebis(oxy))dibenzoato–κ3 O:O′:O′′)(μ2-1-(4-((1H-imidazol-1-yl)methyl)benzyl)-1H-imidazole-κ2 N:N′)tetracobalt(II)], C94H62O24N4Co4
• Authors of publication: Gao, Ye
• Journal of publication: Zeitschrift für Kristallographie - New Crystal Structures
• Year of publication: 2016
• Journal volume: 231
• Journal issue: 1
• Pages of publication: 121 - 123
• a: 9.3604 ± 0.0011 Å
• b: 11.7945 ± 0.0014 Å
• c: 19.805 ± 0.002 Å
• α: 94.227 ± 0.002°
• β: 98.39 ± 0.002°
• γ: 98.965 ± 0.002°
• Cell volume: 2126.2 ± 0.4 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 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: 0.1042
• Residual factor for significantly intense reflections: 0.054
• Weighted residual factors for significantly intense reflections: 0.1163
• Weighted residual factors for all reflections included in the refinement: 0.138
• Goodness-of-fit parameter for all reflections included in the refinement: 0.949
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No