Information card for entry 7122990

Structure parameters

• Formula: C33 H47 Al N3 P
• Calculated formula: C33 H47 Al N3 P
• Title of publication: Unusual ligand rearrangement: from N-phosphinoguanidinato to phosphinimine-amidinato compounds
• Authors of publication: Fernández-Galán, Rafael; Ramos, Alberto; Huergo, Estefanía; Antiñolo, Antonio; Carrillo-Hermosilla, Fernando; Rodríguez-Diéguez, Antonio; García-Vivó, Daniel
• Journal of publication: Chemical Communications
• Year of publication: 2019
• a: 10.081 ± 0.002 Å
• b: 19.984 ± 0.003 Å
• c: 16.631 ± 0.003 Å
• α: 90°
• β: 99.198 ± 0.004°
• γ: 90°
• Cell volume: 3307.4 ± 1 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 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: 0.0932
• Residual factor for significantly intense reflections: 0.0507
• Weighted residual factors for significantly intense reflections: 0.1093
• Weighted residual factors for all reflections included in the refinement: 0.1241
• Goodness-of-fit parameter for all reflections included in the refinement: 0.996
• Diffraction radiation wavelength: 0.71069 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No