Information card for entry 4326141

Structure parameters

• Formula: C31 H32 N O P
• Calculated formula: C31 H32 N O P
• SMILES: P(=Nc1c(cccc1C(C)C)C(C)C)(C)(c1cccc2c1oc1c2cccc1)c1ccccc1
• Title of publication: Toward Stereoselective Lactide Polymerization Catalysts: Cationic Zinc Complexes Supported by a Chiral Phosphinimine Scaffold
• Authors of publication: Hongsui Sun; Jamie S. Ritch; Paul G. Hayes
• Journal of publication: Inorganic Chemistry
• Year of publication: 2011
• Journal volume: 50
• Pages of publication: 8063 - 8072
• a: 9.2839 ± 0.0008 Å
• b: 10.498 ± 0.0007 Å
• c: 13.7598 ± 0.0008 Å
• α: 96.53 ± 0.001°
• β: 101.059 ± 0.001°
• γ: 100.442 ± 0.001°
• Cell volume: 1278.95 ± 0.16 ų
• Cell temperature: 173 ± 2 K
• Ambient diffraction temperature: 173 ± 2 K
• Number of distinct elements: 5
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.057
• Residual factor for significantly intense reflections: 0.0375
• Weighted residual factors for significantly intense reflections: 0.0886
• Weighted residual factors for all reflections included in the refinement: 0.0941
• 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