Information card for entry 7713146

Structure parameters

• Formula: C87 H98 Al2 N8 O4
• Calculated formula: C87 H98 Al2 N8 O4
• Title of publication: Al and Zn phenoxy-amidine complexes for lactide ROP catalysis.
• Authors of publication: Théron, Benjamin; Vaillant-Coindard, Valentin; Balan, Cédric; Rousselin, Yoann; Bayardon, Jérôme; Malacea-Kabbara, Raluca; Le Gendre, Pierre
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2023
• a: 12.4063 ± 0.0012 Å
• b: 13.745 ± 0.0012 Å
• c: 14.0446 ± 0.0013 Å
• α: 110.884 ± 0.003°
• β: 110.057 ± 0.003°
• γ: 104.529 ± 0.004°
• Cell volume: 1902.5 ± 0.3 ų
• Cell temperature: 120 ± 0.1 K
• Ambient diffraction temperature: 120 ± 0.1 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: 0.0858
• Residual factor for significantly intense reflections: 0.0581
• Weighted residual factors for significantly intense reflections: 0.1339
• Weighted residual factors for all reflections included in the refinement: 0.1547
• Goodness-of-fit parameter for all reflections included in the refinement: 1.025
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No