Information card for entry 7019804

Structure parameters

• Formula: C60 H552.5 Mo132 N5 O653.25 Sr18.5
• Calculated formula: C60 Mo132 O658.261 Sr18.514
• Title of publication: Crystallization of a Keplerate-type polyoxometalate into a superposed kagome-lattice with huge channels.
• Authors of publication: Saito, Masaki; Ozeki, Tomoji
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2012
• Journal volume: 41
• Journal issue: 33
• Pages of publication: 9846 - 9848
• a: 61.53 ± 0.001 Å
• b: 61.53 ± 0.001 Å
• c: 63.896 ± 0.001 Å
• α: 90°
• β: 90°
• γ: 120°
• Cell volume: 209497 ± 6 ų
• Cell temperature: 123 ± 2 K
• Ambient diffraction temperature: 123 ± 2 K
• Number of distinct elements: 6
• Space group number: 194
• Hermann-Mauguin space group symbol: P 63/m m c
• Hall space group symbol: -P 6c 2c
• Residual factor for all reflections: 0.1502
• Residual factor for significantly intense reflections: 0.0932
• Weighted residual factors for significantly intense reflections: 0.2676
• Weighted residual factors for all reflections included in the refinement: 0.331
• Goodness-of-fit parameter for all reflections included in the refinement: 1.034
• Diffraction radiation wavelength: 0.689 Å
• Diffraction radiation type: synchrotron
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No