Information card for entry 7007623

Structure parameters

• Formula: C364 H402 Cl12 Mn24 N86 O96
• Calculated formula: C324 H342 Cl12 Mn24 N66 O96
• Title of publication: Making "wheels" and "cubes" from triangles.
• Authors of publication: Scott, Richard T. W.; Milios, Constantinos J.; Vinslava, Alina; Lifford, David; Parsons, Simon; Wernsdorfer, Wolfgang; Christou, George; Brechin, Euan K.
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2006
• Journal issue: 26
• Pages of publication: 3161 - 3163
• a: 29.746 ± 0.0009 Å
• b: 17.829 ± 0.0006 Å
• c: 46.765 ± 0.0015 Å
• α: 90°
• β: 106.019 ± 0.003°
• γ: 90°
• Cell volume: 23838.4 ± 1.4 ų
• Cell temperature: 150 ± 2 K
• Ambient diffraction temperature: 150 ± 2 K
• Number of distinct elements: 6
• 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: 0.137
• Residual factor for significantly intense reflections: 0.1097
• Weighted residual factors for significantly intense reflections: 0.3293
• Weighted residual factors for all reflections included in the refinement: 0.3506
• Goodness-of-fit parameter for all reflections included in the refinement: 1.369
• Diffraction radiation wavelength: 1.5418 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No