Information card for entry 7017902

Structure parameters

• Formula: C20 H22 Al Cl2 N O2
• Calculated formula: C20 H22 Al Cl2 N O2
• SMILES: [N]1([Al](c2c3OCOc3ccc2C=1)(Cl)Cl)c1c(cccc1C(C)C)C(C)C
• Title of publication: Isolation and characterization of main group and late transition metal complexes using orthometallated imine ligands.
• Authors of publication: Beck, John F.; Schmidt, Joseph A. R.
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2012
• Journal volume: 41
• Journal issue: 3
• Pages of publication: 860 - 870
• a: 10.0807 ± 0.0008 Å
• b: 16.6881 ± 0.0013 Å
• c: 12.1637 ± 0.001 Å
• α: 90°
• β: 98.214 ± 0.002°
• γ: 90°
• Cell volume: 2025.3 ± 0.3 ų
• Cell temperature: 140 K
• Ambient diffraction temperature: 140 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: 0.0387
• Residual factor for significantly intense reflections: 0.0352
• Weighted residual factors for significantly intense reflections: 0.0939
• Weighted residual factors for all reflections included in the refinement: 0.0969
• Goodness-of-fit parameter for all reflections included in the refinement: 1.047
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No