Information card for entry 7033865

Structure parameters

• Formula: C59 H231 Mo36 N13 Nd2 O185
• Calculated formula: C54 H96 Mo36 N12 Nd2 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: 18.1342 ± 0.0006 Å
• b: 18.9297 ± 0.0006 Å
• c: 31.2954 ± 0.001 Å
• α: 90°
• β: 103.255 ± 0.001°
• γ: 90°
• Cell volume: 10456.7 ± 0.6 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: 0.0607
• Residual factor for significantly intense reflections: 0.0493
• Weighted residual factors for significantly intense reflections: 0.1398
• Weighted residual factors for all reflections included in the refinement: 0.1465
• Goodness-of-fit parameter for all reflections included in the refinement: 1.069
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No