Information card for entry 4303116

Structure parameters

• Formula: C28 H41 Br Cu N2 P
• Calculated formula: C28 H41 Br Cu N2 P
• Title of publication: Phosphines Bearing Alkyne Substituents: Synthesis and Hydrophosphination Polymerization
• Authors of publication: Sharonna Greenberg; Douglas W. Stephan
• Journal of publication: Inorganic Chemistry
• Year of publication: 2009
• Journal volume: 48
• Pages of publication: 8623 - 8631
• a: 12.21 ± 0.003 Å
• b: 12.162 ± 0.003 Å
• c: 20.067 ± 0.005 Å
• α: 90°
• β: 104.265 ± 0.004°
• γ: 90°
• Cell volume: 2888 ± 1.2 ų
• Cell temperature: 296 ± 2 K
• Ambient diffraction temperature: 296 ± 2 K
• Number of distinct elements: 6
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/c 1
• Hall space group symbol: -P 2ybc
• Residual factor for all reflections: 0.0816
• Residual factor for significantly intense reflections: 0.0505
• Weighted residual factors for significantly intense reflections: 0.1334
• Weighted residual factors for all reflections included in the refinement: 0.1532
• Goodness-of-fit parameter for all reflections included in the refinement: 1.009
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No