Information card for entry 7046030

Structure parameters

• Formula: C46 H54 Al2 Li2 N2 O2
• Calculated formula: C46 H54 Al2 Li2 N2 O2
• Title of publication: Schiff-base -ate derivatives with main group metals: generation of a tripodal aluminate metalloligand.
• Authors of publication: García-Valle, Francisco M; Tabernero, Vanessa; Cuenca, Tomás; Cano, Jesús; Mosquera, Marta E. G.
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2018
• Journal volume: 47
• Journal issue: 18
• Pages of publication: 6499 - 6506
• a: 11.1067 ± 0.0012 Å
• b: 8.8238 ± 0.0011 Å
• c: 22.6234 ± 0.0019 Å
• α: 90°
• β: 94.21 ± 0.007°
• γ: 90°
• Cell volume: 2211.2 ± 0.4 ų
• Cell temperature: 200 ± 2 K
• Ambient diffraction temperature: 200 ± 2 K
• Number of distinct elements: 6
• 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: 0.1097
• Residual factor for significantly intense reflections: 0.0546
• Weighted residual factors for significantly intense reflections: 0.1401
• Weighted residual factors for all reflections included in the refinement: 0.1609
• Goodness-of-fit parameter for all reflections included in the refinement: 0.976
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No