Information card for entry 7124307

Structure parameters

• Formula: C120 H152 Cl N23 O32 V12 Yb2
• Calculated formula: C116 H146 Cl N21 O32 V12 Yb2
• Title of publication: Self-assembled monolayers of polyoxovanadates with phthalocyaninato lanthanide moieties on gold surfaces
• Authors of publication: Pütt, Ricarda; Qiu, Xinkai; Kozłowski, Piotr; Gildenast, Hans; Linnenberg, Oliver; Zahn, Stefan; Chiechi, Ryan; Monakhov, Kirill
• Journal of publication: Chemical Communications
• Year of publication: 2019
• a: 14.84 ± 0.003 Å
• b: 14.84 ± 0.003 Å
• c: 35.452 ± 0.008 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 7807 ± 3 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 7
• Space group number: 82
• Hermann-Mauguin space group symbol: I -4
• Hall space group symbol: I -4
• Residual factor for all reflections: 0.1102
• Residual factor for significantly intense reflections: 0.0777
• Weighted residual factors for significantly intense reflections: 0.2085
• Weighted residual factors for all reflections included in the refinement: 0.2347
• Goodness-of-fit parameter for all reflections included in the refinement: 1.056
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No