Information card for entry 4130511

Structure parameters

• Formula: C21 H24 Al P
• Calculated formula: C21 H24 Al P
• SMILES: c1(ccccc1)[Al]([P](C)(C)C)(c1ccccc1)c1ccccc1
• Title of publication: End of Frustration: Catalytic Precision Polymerization with Highly Interacting Lewis Pairs.
• Authors of publication: Knaus, Maximilian G. M.; Giuman, Marco M.; Pöthig, Alexander; Rieger, Bernhard
• Journal of publication: Journal of the American Chemical Society
• Year of publication: 2016
• Journal volume: 138
• Journal issue: 24
• Pages of publication: 7776 - 7781
• a: 12.0529 ± 0.001 Å
• b: 12.0529 ± 0.001 Å
• c: 7.4996 ± 0.0007 Å
• α: 90°
• β: 90°
• γ: 120°
• Cell volume: 943.52 ± 0.14 ų
• Cell temperature: 123 K
• Ambient diffraction temperature: 123 K
• Number of distinct elements: 4
• Space group number: 159
• Hermann-Mauguin space group symbol: P 3 1 c
• Hall space group symbol: P 3 -2c
• Residual factor for all reflections: 0.0434
• Residual factor for significantly intense reflections: 0.0384
• Weighted residual factors for significantly intense reflections: 0.092
• Weighted residual factors for all reflections included in the refinement: 0.0949
• Goodness-of-fit parameter for all reflections included in the refinement: 1.078
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No