Information card for entry 4131879

Structure parameters

• Formula: C38 H276 As4 N19 Na17 O284 P4 W64
• Calculated formula: C6.7 As4 N3.35 Na8.55 O276.85 P4 W64
• Title of publication: Self-Sorting of Heteroanions in the Assembly of Cross-Shaped Polyoxometalate Clusters.
• Authors of publication: Zheng, Qi; Vilà-Nadal, Laia; Lang, Zhongling; Chen, Jia-Jia; Long, De-Liang; Mathieson, Jennifer S.; Poblet, Josep M.; Cronin, Leroy
• Journal of publication: Journal of the American Chemical Society
• Year of publication: 2018
• Journal volume: 140
• Journal issue: 7
• Pages of publication: 2595 - 2601
• a: 57.258 ± 0.003 Å
• b: 15.0627 ± 0.0008 Å
• c: 77.278 ± 0.004 Å
• α: 90°
• β: 91.453 ± 0.006°
• γ: 90°
• Cell volume: 66628 ± 6 ų
• Cell temperature: 150 ± 2 K
• Ambient diffraction temperature: 150 ± 2 K
• Number of distinct elements: 8
• Space group number: 15
• Hermann-Mauguin space group symbol: C 1 2/c 1
• Hall space group symbol: -C 2yc
• Residual factor for all reflections: 0.1195
• Residual factor for significantly intense reflections: 0.0693
• Weighted residual factors for significantly intense reflections: 0.1527
• Weighted residual factors for all reflections included in the refinement: 0.1804
• Goodness-of-fit parameter for all reflections included in the refinement: 1.029
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No