Information card for entry 7023085

Structure parameters

• Formula: Ge K2 O50 W12
• Calculated formula: Ge K2 O50 W12
• SMILES: [K+].O=[W]1234[O]56[W]78(O[W]9%10%11(O[W]%12%13%14(=O)O[W]%15(O[W]%16%17(O[W]%18%19%20(=O)O[W]6(O2)(=O)(O8)O[W]26(O%18)([O]8%18[Ge]5([O]%16%19[W](O%12)(O[W]8(O[W]%18(O9)(=O)(O6)O7)(=O)(O%13)O2)(O%20)(=O)O%17)[O]%10%14%15)=O)(=O)O3)(O4)(O%11)=O)=O)(O1)=O.O.O.O.O.O.[K+].O.O.O.O.O
• Title of publication: Assembly and spontaneous resolution of the chiral inorganic polyoxometalates-based frameworks via helical chains association.
• Authors of publication: Tang, Qun; Liu, Shuxia; Liu, Yiwei; Li, Shujun; Ma, Fengji; Li, Jianxin; Wang, Shengtian; Liu, Chengzhan
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2013
• Journal volume: 42
• Journal issue: 23
• Pages of publication: 8512 - 8518
• a: 19.1223 ± 0.0004 Å
• b: 19.1223 ± 0.0004 Å
• c: 12.5392 ± 0.0004 Å
• α: 90°
• β: 90°
• γ: 120°
• Cell volume: 3970.82 ± 0.17 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 4
• Space group number: 180
• Hermann-Mauguin space group symbol: P 62 2 2
• Hall space group symbol: P 62 2 (0 0 4)
• Residual factor for all reflections: 0.063
• Residual factor for significantly intense reflections: 0.0431
• Weighted residual factors for significantly intense reflections: 0.0957
• Weighted residual factors for all reflections included in the refinement: 0.1041
• Goodness-of-fit parameter for all reflections included in the refinement: 1.001
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No