Information card for entry 7121780

Structure parameters

• Common name: [(Pn?)Y(Cp*)]
• Formula: C36 H61 Si2 Y
• Calculated formula: C36 H61 Si2 Y
• Title of publication: Single-molecule magnet properties of a monometallic dysprosium pentalene complex.
• Authors of publication: Kilpatrick, Alexander F. R.; Guo, Fu-Sheng; Day, Benjamin M.; Mansikkamäki, Akseli; Layfield, Richard A.; Cloke, F Geoffrey N
• Journal of publication: Chemical communications (Cambridge, England)
• Year of publication: 2018
• Journal volume: 54
• Journal issue: 51
• Pages of publication: 7085 - 7088
• a: 9.7114 ± 0.0004 Å
• b: 12.7624 ± 0.0006 Å
• c: 15.9778 ± 0.0008 Å
• α: 72.103 ± 0.004°
• β: 75.026 ± 0.004°
• γ: 80.722 ± 0.004°
• Cell volume: 1813.26 ± 0.15 ų
• Cell temperature: 173 ± 2 K
• Ambient diffraction temperature: 173 ± 2 K
• Number of distinct elements: 4
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0598
• Residual factor for significantly intense reflections: 0.0571
• Weighted residual factors for significantly intense reflections: 0.1496
• Weighted residual factors for all reflections included in the refinement: 0.1536
• Goodness-of-fit parameter for all reflections included in the refinement: 0.937
• Diffraction radiation wavelength: 1.54184 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No