Information card for entry 7017592

Structure parameters

• Formula: Co2 H64 K10 Na O98 Si2 W18
• Calculated formula: Co2 K10 Na O83.75 Si2 W18
• Title of publication: Water oxidation catalyzed by a new tetracobalt-substituted polyoxometalate complex: [{Co(4)(μ-OH)(H(2)O)(3)}(Si(2)W(19)O(70))](11-).
• Authors of publication: Zhu, Guibo; Geletii, Yurii V.; Kögerler, Paul; Schilder, Helmut; Song, Jie; Lense, Sheri; Zhao, Chongchao; Hardcastle, Kenneth I.; Musaev, Djamaladdin G.; Hill, Craig L.
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2012
• Journal volume: 41
• Journal issue: 7
• Pages of publication: 2084 - 2090
• a: 14.632 ± 0.004 Å
• b: 18.179 ± 0.004 Å
• c: 18.284 ± 0.004 Å
• α: 65.974 ± 0.003°
• β: 79.207 ± 0.004°
• γ: 86.471 ± 0.004°
• Cell volume: 4362.9 ± 1.8 ų
• Cell temperature: 173 ± 2 K
• Ambient diffraction temperature: 173 ± 2 K
• Number of distinct elements: 7
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0581
• Residual factor for significantly intense reflections: 0.0449
• Weighted residual factors for significantly intense reflections: 0.1125
• Weighted residual factors for all reflections included in the refinement: 0.1204
• Goodness-of-fit parameter for all reflections included in the refinement: 1.026
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No