Information card for entry 7115177

Structure parameters

• Formula: H480 Mo75 Na30 O550 S10 V20
• Calculated formula: Mo75 Na13.5 O534 S10 V20
• Title of publication: Building blocks as disposition in solution: [{MoVIO3(H2O)}10{VIVO(H2O)}20{(MoVI/MoVI5O21)(H2O)3}10({MoVIO2(H2O)2}5/2)2 ({NaSO4}5)2]20−, a giant spherical cluster with unusual structural features of interest for supramolecular and magneto chemistry
• Authors of publication: Müller, Achim; Koop, Michael; Bögge, Hartmut; Schmidtmann, Marc; Peters, Frank; Kögerler, Paul
• Journal of publication: Chemical Communications
• Year of publication: 1999
• Journal issue: 18
• Pages of publication: 1885
• a: 47.065 ± 0.002 Å
• b: 43.157 ± 0.002 Å
• c: 26.9461 ± 0.0012 Å
• α: 90°
• β: 104.262 ± 0.001°
• γ: 90°
• Cell volume: 53046 ± 4 ų
• Cell temperature: 183 ± 2 K
• Ambient diffraction temperature: 183 ± 2 K
• Number of distinct elements: 6
• Space group number: 15
• Hermann-Mauguin space group symbol: C 1 2/c 1
• Hall space group symbol: -C 2yc
• Residual factor for all reflections: 0.1285
• Residual factor for significantly intense reflections: 0.0616
• Weighted residual factors for significantly intense reflections: 0.1532
• Weighted residual factors for all reflections included in the refinement: 0.2063
• Goodness-of-fit parameter for all reflections included in the refinement: 1.072
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No