Information card for entry 4107400

Structure parameters

• Common name: DL226
• Formula: H66 Na7 O92 Sb W18
• Calculated formula: Na7 O91.56 Sb W18
• Title of publication: Unravelling the Complexities of Polyoxometalates in Solution Using Mass Spectrometry: Protonation versus Heteroatom Inclusion
• Authors of publication: De-Liang Long; Carsten Streb; Yu-Fei Song; Scott Mitchell; Leroy Cronin
• Journal of publication: Journal of the American Chemical Society
• Year of publication: 2008
• Journal volume: 130
• Pages of publication: 1830 - 1832
• a: 27.1559 ± 0.0012 Å
• b: 15.5424 ± 0.0007 Å
• c: 21.7182 ± 0.0016 Å
• α: 90°
• β: 123.467 ± 0.002°
• γ: 90°
• Cell volume: 7646.8 ± 0.8 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 5
• 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: 0.0517
• Residual factor for significantly intense reflections: 0.0362
• Weighted residual factors for significantly intense reflections: 0.0822
• Weighted residual factors for all reflections included in the refinement: 0.088
• Goodness-of-fit parameter for all reflections included in the refinement: 1.079
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No