Information card for entry 1566333

Structure parameters

• Formula: C26 H55 N O13.5 V3
• Calculated formula: C26 H55 N O13.5 V3
• Title of publication: Versatile post-functionalisation strategy for the formation of modular organic-inorganic polyoxometalate hybrids.
• Authors of publication: Salazar Marcano, David E.; Moussawi, Mhamad Aly; Anyushin, Alexander V.; Lentink, Sarah; Van Meervelt, Luc; Ivanović-Burmazović, Ivana; Parac-Vogt, Tatjana N
• Journal of publication: Chemical science
• Year of publication: 2022
• Journal volume: 13
• Journal issue: 10
• Pages of publication: 2891 - 2899
• a: 13.052 ± 0.0012 Å
• b: 13.4949 ± 0.0009 Å
• c: 20.5929 ± 0.001 Å
• α: 90°
• β: 104.803 ± 0.008°
• γ: 90°
• Cell volume: 3506.8 ± 0.5 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 5
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/c 1
• Hall space group symbol: -P 2ybc
• Residual factor for all reflections: 0.1287
• Residual factor for significantly intense reflections: 0.0857
• Weighted residual factors for significantly intense reflections: 0.2097
• Weighted residual factors for all reflections included in the refinement: 0.246
• Goodness-of-fit parameter for all reflections included in the refinement: 1.054
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No