Information card for entry 7058258

Structure parameters

• Formula: C4 H72 Cu N4 Na8 O74 W12
• Calculated formula: C4 H8 Cu N4 Na8 O74 W12
• Title of publication: Two isopolytungstate compounds based on rare [W6O22]8− and [H2W12O42]10− fragments captured by premade copper(ii) complexes
• Authors of publication: Ying, Jun; Chen, Ya-Guang; Wang, Xiu-Yan
• Journal of publication: New Journal of Chemistry
• Year of publication: 2019
• Journal volume: 43
• Journal issue: 17
• Pages of publication: 6765
• a: 11.802 ± 0.005 Å
• b: 12.989 ± 0.005 Å
• c: 14.21 ± 0.006 Å
• α: 63.158 ± 0.007°
• β: 82.957 ± 0.008°
• γ: 68.761 ± 0.007°
• Cell volume: 1809.4 ± 1.3 ų
• Cell temperature: 296 ± 2 K
• Ambient diffraction temperature: 296 ± 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: 0.068
• Residual factor for significantly intense reflections: 0.0382
• Weighted residual factors for significantly intense reflections: 0.0674
• Weighted residual factors for all reflections included in the refinement: 0.0754
• Goodness-of-fit parameter for all reflections included in the refinement: 1.004
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No