Information card for entry 7063446

Structure parameters

• Formula: C66 H52 F6 N6 O10 P2 V2
• Calculated formula: C66 H52 F6 N6 O10 P2 V2
• Title of publication: Zwitterionic dioxidovanadium(v) complexes containing fluorinated triphenylphosphonium ligands: Structure and biomacromolecules studies
• Authors of publication: Martins, Francisco Mainardi; Durigon, Daniele C.; Chaves, Otávio Augusto Augusto; Peralta, Rosely; Back, Davi; Terenzi, Hernan
• Journal of publication: New Journal of Chemistry
• Year of publication: 2024
• a: 14.696 ± 0.004 Å
• b: 14.852 ± 0.004 Å
• c: 16.796 ± 0.004 Å
• α: 111.604 ± 0.007°
• β: 91.134 ± 0.008°
• γ: 111.054 ± 0.008°
• Cell volume: 3131.7 ± 1.4 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 7
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.1123
• Residual factor for significantly intense reflections: 0.0951
• Weighted residual factors for significantly intense reflections: 0.165
• Weighted residual factors for all reflections included in the refinement: 0.1034
• Goodness-of-fit parameter for all reflections included in the refinement: 1.008
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No