Information card for entry 7042538

Structure parameters

• Formula: C66 H134 N2 O25 V6
• Calculated formula: C66 H134 N2 O25 V6
• Title of publication: A simple synthetic route to polyoxovanadate-based organic-inorganic hybrids using EEDQ as an ester coupling agent.
• Authors of publication: Bayaguud, Aruuhan; Li, JianDa; She, Shan; Wei, Yongge
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2017
• Journal volume: 46
• Journal issue: 14
• Pages of publication: 4602 - 4608
• a: 18.275 ± 0.0006 Å
• b: 17.3035 ± 0.0007 Å
• c: 27.3203 ± 0.0011 Å
• α: 90°
• β: 99.021 ± 0.003°
• γ: 90°
• Cell volume: 8532.4 ± 0.6 ų
• Cell temperature: 104.3 K
• Ambient diffraction temperature: 104.3 K
• Number of distinct elements: 5
• Space group number: 15
• Hermann-Mauguin space group symbol: C 1 2/c 1
• Hall space group symbol: -C 2yc
• Residual factor for all reflections: 0.1174
• Residual factor for significantly intense reflections: 0.0843
• Weighted residual factors for significantly intense reflections: 0.19
• Weighted residual factors for all reflections included in the refinement: 0.2119
• Goodness-of-fit parameter for all reflections included in the refinement: 1.054
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No