Information card for entry 7013509

Structure parameters

• Formula: C61.5 H71 Co4 N4 O12.5
• Calculated formula: C61.75 H68 Co4 N4 O12
• Title of publication: Synthesis, structure and magnetic properties of hydroxyquinaldine-bridged cobalt and nickel cubanes
• Authors of publication: Guillem Aromí; Andrei S. Batsanov; Paul Christian; Madeleine Helliwell; Olivier Roubeau; Grigore A. Timco; Richard E. P. Winpenny
• Journal of publication: Dalton Trans.
• Year of publication: 2003
• Journal issue: 23
• Pages of publication: 4466 - 4471
• a: 15.798 ± 0.005 Å
• b: 13.933 ± 0.004 Å
• c: 27.648 ± 0.007 Å
• α: 90°
• β: 99.19 ± 0.01°
• γ: 90°
• Cell volume: 6008 ± 3 ų
• Cell temperature: 120 ± 2 K
• Ambient diffraction temperature: 120 ± 2 K
• Number of distinct elements: 5
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/c 1
• Hall space group symbol: -P 2ybc
• Residual factor for all reflections: 0.0564
• Residual factor for significantly intense reflections: 0.0391
• Weighted residual factors for significantly intense reflections: 0.0839
• Weighted residual factors for all reflections included in the refinement: 0.0932
• Goodness-of-fit parameter for all reflections included in the refinement: 1.117
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No