Information card for entry 4101463

Structure parameters

• Formula: C42 H84 Cl2 P2 Pd
• Calculated formula: C41.992 H84 Cl2 P2 Pd
• Title of publication: Gyroscope-like molecules consisting of PdX2/PtX2 rotators encased in three-spoke stators: synthesis via alkene metathesis, and facile substitution and demetalation.
• Authors of publication: Nawara, Agnieszka J; Shima, Takanori; Hampel, Frank; Gladysz, J A
• Journal of publication: Journal of the American Chemical Society
• Year of publication: 2006
• Journal volume: 128
• Journal issue: 15
• Pages of publication: 4962 - 4963
• a: 16.2233 ± 0.0002 Å
• b: 13.7836 ± 0.0003 Å
• c: 20.1744 ± 0.0004 Å
• α: 90°
• β: 91.207 ± 0.001°
• γ: 90°
• Cell volume: 4510.31 ± 0.14 ų
• Cell temperature: 173 ± 2 K
• Ambient diffraction temperature: 173 ± 2 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: 0.0344
• Weighted residual factors for significantly intense reflections: 0.0732
• Weighted residual factors for all reflections included in the refinement: 0.0823
• Goodness-of-fit parameter for all reflections included in the refinement: 0.963
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No