Information card for entry 7042539

Structure parameters

• Formula: C56 H114 N2 O29 V6
• Calculated formula: C56 H114 N2 O29 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: 13.504 ± 0.003 Å
• b: 17.74 ± 0.004 Å
• c: 15.324 ± 0.003 Å
• α: 90°
• β: 108.64 ± 0.03°
• γ: 90°
• Cell volume: 3478.5 ± 1.4 ų
• Cell temperature: 153.15 K
• Ambient diffraction temperature: 153.15 K
• Number of distinct elements: 5
• 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: 0.0646
• Residual factor for significantly intense reflections: 0.0586
• Weighted residual factors for significantly intense reflections: 0.1459
• Weighted residual factors for all reflections included in the refinement: 0.1506
• Goodness-of-fit parameter for all reflections included in the refinement: 1.114
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No