Information card for entry 7029383

Structure parameters

• Formula: Fe13 H146 Na33 O319 P12 W60
• Calculated formula: Fe13 Na20 O318.9 P12 W60
• Title of publication: Assembly and core transformation properties of two tetrahedral clusters: [Fe(III)13P8W60O227(OH)15(H2O)2](30-) and [Fe(III)13P8W60O224(OH)12(PO4)4](33-).
• Authors of publication: Molina, Pedro I.; Miras, Haralampos N.; Long, De-Liang; Cronin, Leroy
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2014
• Journal volume: 43
• Journal issue: 13
• Pages of publication: 5190 - 5199
• a: 24.8202 ± 0.0003 Å
• b: 27.1921 ± 0.0004 Å
• c: 31.4135 ± 0.0004 Å
• α: 70.5521 ± 0.0012°
• β: 86.2853 ± 0.0009°
• γ: 69.6989 ± 0.0012°
• Cell volume: 18719 ± 0.5 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: 0.1127
• Residual factor for significantly intense reflections: 0.0583
• Weighted residual factors for significantly intense reflections: 0.1303
• Weighted residual factors for all reflections included in the refinement: 0.1608
• Goodness-of-fit parameter for all reflections included in the refinement: 1.027
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No