Information card for entry 7111258

Structure parameters

• Formula: C57.75 H80 O6 P2 Pd2
• Calculated formula: C57.75 H80 O6 P2 Pd2
• Title of publication: Chiral pentacyclic phosphines as a new ligand class
• Authors of publication: Haigh, Robert; Malik, K. M. Abdul; Newman, Paul D.
• Journal of publication: Chemical Communications
• Year of publication: 2002
• Journal issue: 21
• Pages of publication: 2558 - 2559
• a: 12.7814 ± 0.0002 Å
• b: 18.9991 ± 0.0003 Å
• c: 23.0978 ± 0.0005 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 5608.96 ± 0.17 ų
• Cell temperature: 150 ± 2 K
• Ambient diffraction temperature: 150 ± 2 K
• Number of distinct elements: 5
• Space group number: 19
• Hermann-Mauguin space group symbol: P 21 21 21
• Hall space group symbol: P 2ac 2ab
• Residual factor for all reflections: 0.0602
• Residual factor for significantly intense reflections: 0.0456
• Weighted residual factors for significantly intense reflections: 0.0944
• Weighted residual factors for all reflections included in the refinement: 0.1012
• Goodness-of-fit parameter for all reflections included in the refinement: 1.089
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No