Information card for entry 7031005

Structure parameters

• Formula: C64 H140 Cr Mo6 N5 O28
• Calculated formula: C63.4 H131.67 Cr Mo6 N5 O28
• Title of publication: Step-by-step covalent modification of Cr-templated Anderson-type polyoxometalates.
• Authors of publication: Lin, Chang-Gen; Chen, Wei; Long, De-Liang; Cronin, Leroy; Song, Yu-Fei
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2014
• Journal volume: 43
• Journal issue: 23
• Pages of publication: 8587 - 8590
• a: 25.2904 ± 0.0016 Å
• b: 13.7087 ± 0.0009 Å
• c: 24.6841 ± 0.0016 Å
• α: 90°
• β: 90.966 ± 0.004°
• γ: 90°
• Cell volume: 8556.7 ± 1 ų
• Cell temperature: 150 ± 2 K
• Ambient diffraction temperature: 150 ± 2 K
• Number of distinct elements: 6
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/c 1
• Hall space group symbol: -P 2ybc
• Residual factor for all reflections: 0.109
• Residual factor for significantly intense reflections: 0.0814
• Weighted residual factors for significantly intense reflections: 0.2072
• Weighted residual factors for all reflections included in the refinement: 0.23
• Goodness-of-fit parameter for all reflections included in the refinement: 1.055
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No