Information card for entry 7007119

Structure parameters

• Common name: na
• Formula: C72.5 H110 Mn9 Mo3.12 N48 O30.5 Re2.88
• Calculated formula: C72.5 Mn9 Mo3.12 N48 O30.5 Re2.88
• Title of publication: Symmetry-breaking substitutions of [Re(CN)8]3- into the centered, face-capped octahedral clusters (CH3OH)24M9M'6(CN)48 (M = Mn, Co; M = Mo, W).
• Authors of publication: Freedman, Danna E.; Bennett, Miriam V.; Long, Jeffrey R.
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2006
• Journal issue: 23
• Pages of publication: 2829 - 2834
• a: 29.385 ± 0.004 Å
• b: 18.742 ± 0.003 Å
• c: 32.641 ± 0.005 Å
• α: 90°
• β: 114.837 ± 0.003°
• γ: 90°
• Cell volume: 16314 ± 4 ų
• Cell temperature: 179 K
• Ambient diffraction temperature: 179 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: 0.138
• Residual factor for significantly intense reflections: 0.1031
• Weighted residual factors for significantly intense reflections: 0.2647
• Weighted residual factors for all reflections included in the refinement: 0.2925
• Goodness-of-fit parameter for all reflections included in the refinement: 1.213
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No