Information card for entry 7019738

Structure parameters

• Formula: C84 H120 Cl2 Co5 O46 Sb12
• Calculated formula: C84 H84 Cl1.98 Co5 O46 Sb12
• Title of publication: Isopolyoxometalates derived from arylstibonic acids with "reverse-Keggin ion" structures based on [M(RSb)(12)O(28)] cores, M = Co(ii) or Zn(ii).
• Authors of publication: Nicholson, Brian K.; Clark, Christopher J.; Telfer, Shane G.; Groutso, Tania
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2012
• Journal volume: 41
• Journal issue: 33
• Pages of publication: 9964 - 9970
• a: 16.5969 ± 0.0007 Å
• b: 16.5969 ± 0.0007 Å
• c: 24.2315 ± 0.0017 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 6674.7 ± 0.6 ų
• Cell temperature: 139 ± 2 K
• Ambient diffraction temperature: 139 ± 2 K
• Number of distinct elements: 6
• Space group number: 118
• Hermann-Mauguin space group symbol: P -4 n 2
• Hall space group symbol: P -4 -2n
• Residual factor for all reflections: 0.054
• Residual factor for significantly intense reflections: 0.0459
• Weighted residual factors for significantly intense reflections: 0.1231
• Weighted residual factors for all reflections included in the refinement: 0.131
• Goodness-of-fit parameter for all reflections included in the refinement: 1.046
• Diffraction radiation wavelength: 1.54178 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No