Information card for entry 7112396

Structure parameters

• Formula: C180 H279 B4 Co13 Fe4 N52 O45.5
• Calculated formula: C180 H268 B4 Co13 Fe4 N52 O45.5
• Title of publication: A cyanide and hydroxo-bridged nanocage: a new generation of coordination clusters.
• Authors of publication: Mondal, Abhishake; Durdevic, Sonja; Chamoreau, Lise-Marie; Journaux, Yves; Julve, Miguel; Lisnard, Laurent; Lescouëzec, Rodrigue
• Journal of publication: Chemical communications (Cambridge, England)
• Year of publication: 2013
• Journal volume: 49
• Journal issue: 12
• Pages of publication: 1181 - 1183
• a: 20.6791 ± 0.0007 Å
• b: 36.3243 ± 0.0013 Å
• c: 34.1575 ± 0.0012 Å
• α: 90°
• β: 90.429 ± 0.001°
• γ: 90°
• Cell volume: 25656.8 ± 1.6 ų
• Cell temperature: 200 ± 2 K
• Ambient diffraction temperature: 200 ± 2 K
• Number of distinct elements: 7
• Space group number: 9
• Hermann-Mauguin space group symbol: C 1 c 1
• Hall space group symbol: C -2yc
• Residual factor for all reflections: 0.058
• Residual factor for significantly intense reflections: 0.0453
• Weighted residual factors for significantly intense reflections: 0.1236
• Weighted residual factors for all reflections included in the refinement: 0.1346
• Goodness-of-fit parameter for all reflections included in the refinement: 1.032
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Duplicate of: 7108822
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No