Information card for entry 2232681

Structure parameters

• Chemical name: μ~3~-Dodecatungsto(V,VI)aluminato- κ^3^<i>O</i>:<i>O</i>':<i>O</i>''-tris[aquabis(ethylenediamine- κ^2^<i>N</i>,<i>N</i>')copper(II)]
• Formula: C12 H54 Al Cu3 N12 O43 W12
• Calculated formula: C12 H54 Al Cu3 N12 O43 W12
• Title of publication: μ~3~-Dodecatungsto(V,VI)aluminato-κ^3^<i>O</i>:<i>O</i>':<i>O</i>''-tris[aquabis(ethylenediamine-κ^2^<i>N</i>,<i>N</i>')copper(II)]
• Authors of publication: Lu, Yu-Kun; Qu, Yuan-Yuan; Tian, Ming-Ming; Diao, Cheng-Lin; Liu, Yun-Qi
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2011
• Journal volume: 67
• Journal issue: 12
• Pages of publication: m1778 - m1779
• a: 17.9719 ± 0.0014 Å
• b: 17.9719 ± 0.0014 Å
• c: 29.335 ± 0.005 Å
• α: 90°
• β: 90°
• γ: 120°
• Cell volume: 8205.5 ± 1.7 ų
• Cell temperature: 296 ± 2 K
• Ambient diffraction temperature: 296 ± 2 K
• Number of distinct elements: 7
• Space group number: 167
• Hermann-Mauguin space group symbol: R -3 c :H
• Hall space group symbol: -R 3 2"c
• Residual factor for all reflections: 0.0478
• Residual factor for significantly intense reflections: 0.0348
• Weighted residual factors for significantly intense reflections: 0.0663
• Weighted residual factors for all reflections included in the refinement: 0.0706
• Goodness-of-fit parameter for all reflections included in the refinement: 1.097
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes