Information card for entry 7031004

Structure parameters

• Formula: C53 H142 Cr Mo6 N3 O35
• Calculated formula: C52.2 H117 Cr Mo6 N3 O35
• 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: 15.164 ± 0.003 Å
• b: 21.818 ± 0.004 Å
• c: 25.095 ± 0.005 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 8303 ± 3 ų
• Cell temperature: 153 ± 2 K
• Ambient diffraction temperature: 153 ± 2 K
• Number of distinct elements: 6
• Space group number: 19
• Hermann-Mauguin space group symbol: P 21 21 21
• Hall space group symbol: P 2ac 2ab
• Residual factor for all reflections: 0.0415
• Residual factor for significantly intense reflections: 0.0403
• Weighted residual factors for significantly intense reflections: 0.097
• Weighted residual factors for all reflections included in the refinement: 0.0979
• Goodness-of-fit parameter for all reflections included in the refinement: 1.083
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No