Information card for entry 7036320

Structure parameters

• Formula: C39 H68 Mo12 N8 O36
• Calculated formula: C39 H68 Mo12 N8 O36
• Title of publication: Postfunctionalization of polyoxometalates: an efficient strategy to construct organic-inorganic zwitterions.
• Authors of publication: Lv, Chunlin; Hu, Junjie; Khan, Rao Naumaan Nasim; Zhang, Jin; Wei, Yongge
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2015
• Journal volume: 44
• Journal issue: 38
• Pages of publication: 16698 - 16702
• a: 10.885 ± 0.002 Å
• b: 17.838 ± 0.004 Å
• c: 18.104 ± 0.004 Å
• α: 94.83 ± 0.03°
• β: 91.43 ± 0.03°
• γ: 105.85 ± 0.03°
• Cell volume: 3365.3 ± 1.3 ų
• Cell temperature: 103 ± 2 K
• Ambient diffraction temperature: 103 ± 2 K
• Number of distinct elements: 5
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0538
• Residual factor for significantly intense reflections: 0.045
• Weighted residual factors for significantly intense reflections: 0.0832
• Weighted residual factors for all reflections included in the refinement: 0.0866
• Goodness-of-fit parameter for all reflections included in the refinement: 1.177
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No