Information card for entry 7719735

Structure parameters

• Formula: C81 H110 Al4 Cl2 N8
• Calculated formula: C81 H110 Al4 Cl2 N8
• Title of publication: Tetra- and penta-coordinated aluminum complexes with bis-amidine ligands and their reactivity for efficient CO₂ transformation to cyclic carbonates.
• Authors of publication: Acuña, Alejandra; Villegas-Escobar, Nery; Gómez Zamorano, Fernando; Keim-Gyllen, Nicole; Mallet-Ladeira, Sonia; Maerten, Eddy; Madec, David; Rojas, René S
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2025
• Journal volume: 54
• Journal issue: 46
• Pages of publication: 17180 - 17188
• a: 13.6197 ± 0.0008 Å
• b: 16.5022 ± 0.001 Å
• c: 18.7841 ± 0.0012 Å
• α: 97.99 ± 0.002°
• β: 90.083 ± 0.002°
• γ: 93.983 ± 0.002°
• Cell volume: 4170.5 ± 0.4 ų
• Cell temperature: 193 ± 2 K
• Ambient diffraction temperature: 193 ± 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: 0.1051
• Residual factor for significantly intense reflections: 0.0746
• Weighted residual factors for significantly intense reflections: 0.2087
• Weighted residual factors for all reflections included in the refinement: 0.2388
• 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