Information card for entry 7040154

Structure parameters

• Formula: C60 H55 B3 Cl4 Co2 F13 N11 O
• Calculated formula: C60 H53 B3 Cl4 Co2 F13 N11 O
• Title of publication: Substituent effects of N4 Schiff base ligands on the formation of fluoride-bridged dicobalt(ii) complexes via B-F abstraction: structures and magnetism.
• Authors of publication: Cho, Yae In; Ward, Meredith L.; Rose, Michael J.
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2016
• Journal volume: 45
• Journal issue: 34
• Pages of publication: 13466 - 13476
• a: 23.665 ± 0.002 Å
• b: 14.6648 ± 0.0013 Å
• c: 18.7222 ± 0.0017 Å
• α: 90°
• β: 102.917 ± 0.003°
• γ: 90°
• Cell volume: 6333 ± 1 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 8
• Space group number: 15
• Hermann-Mauguin space group symbol: C 1 2/c 1
• Hall space group symbol: -C 2yc
• Residual factor for all reflections: 0.0521
• Residual factor for significantly intense reflections: 0.0452
• Weighted residual factors for significantly intense reflections: 0.1089
• Weighted residual factors for all reflections included in the refinement: 0.1124
• Goodness-of-fit parameter for all reflections included in the refinement: 1.073
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No