Information card for entry 7033870

Structure parameters

• Formula: C59 H205 Er2 Mo36 N13 O172
• Calculated formula: C54 H96 Er2 Mo36 N12 O154
• Title of publication: Organic-inorganic hybrid rare earth complexes based on polymolybdates with intrinsic photosensitive properties.
• Authors of publication: Wang, Yuan; Ma, Pengtao; Niu, Jingyang
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2015
• Journal volume: 44
• Journal issue: 10
• Pages of publication: 4679 - 4682
• a: 18.1548 ± 0.0007 Å
• b: 18.9687 ± 0.0007 Å
• c: 31.1244 ± 0.0012 Å
• α: 90°
• β: 103.486 ± 0.001°
• γ: 90°
• Cell volume: 10422.9 ± 0.7 ų
• Cell temperature: 296 ± 2 K
• Ambient diffraction temperature: 296 ± 2 K
• Number of distinct elements: 6
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/n 1
• Hall space group symbol: -P 2yn
• Residual factor for all reflections: 0.051
• Residual factor for significantly intense reflections: 0.0432
• Weighted residual factors for significantly intense reflections: 0.1105
• Weighted residual factors for all reflections included in the refinement: 0.1147
• Goodness-of-fit parameter for all reflections included in the refinement: 1.043
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No