Information card for entry 4122503

Structure parameters

• Formula: Fe3 H54 K10 O95 Si2 W18
• Calculated formula: Fe3.008 K10.5 O92.4 Si2 W17.992
• Title of publication: Controlling the minimal self assembly of "complex" polyoxometalate clusters.
• Authors of publication: Winter, Ross S.; Cameron, Jamie M.; Cronin, Leroy
• Journal of publication: Journal of the American Chemical Society
• Year of publication: 2014
• Journal volume: 136
• Journal issue: 36
• Pages of publication: 12753 - 12761
• a: 12.6679 ± 0.0002 Å
• b: 18.3023 ± 0.0004 Å
• c: 19.2853 ± 0.0004 Å
• α: 77.37 ± 0.002°
• β: 89.658 ± 0.002°
• γ: 72.081 ± 0.002°
• Cell volume: 4142.43 ± 0.15 ų
• Cell temperature: 150 ± 2 K
• Ambient diffraction temperature: 150 ± 2 K
• Number of distinct elements: 6
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0399
• Residual factor for significantly intense reflections: 0.0304
• Weighted residual factors for significantly intense reflections: 0.0632
• Weighted residual factors for all reflections included in the refinement: 0.0664
• Goodness-of-fit parameter for all reflections included in the refinement: 1.058
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No