Information card for entry 7060675

Structure parameters

• Chemical name: LAlMe2 (Pipp)
• Formula: C36 H58 Al N3 P2
• Calculated formula: C36 H58 Al N3 P2
• SMILES: P1(=[N]([Al]2(n3c1ccc3P(=[N]2c1ccc(cc1)C(C)C)(C(C)C)C(C)C)(C)C)c1ccc(cc1)C(C)C)(C(C)C)C(C)C
• Title of publication: Synthesis and characterization of group 13 dichloride (M = Ga, In), dimethyl (M = Al) and cationic methyl aluminum complexes supported by monoanionic NNN-pincer ligands
• Authors of publication: Chisholm, Desmond T.; Hayes, Paul G.
• Journal of publication: New Journal of Chemistry
• Year of publication: 2021
• Journal volume: 45
• Journal issue: 33
• Pages of publication: 15043 - 15052
• a: 16.246 ± 0.0002 Å
• b: 24.0391 ± 0.0002 Å
• c: 20.6349 ± 0.0003 Å
• α: 90°
• β: 112.981 ± 0.001°
• γ: 90°
• Cell volume: 7419.15 ± 0.16 ų
• Cell temperature: 100 ± 0.2 K
• Ambient diffraction temperature: 100 ± 0.2 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: 0.0478
• Residual factor for significantly intense reflections: 0.0391
• Weighted residual factors for significantly intense reflections: 0.1002
• Weighted residual factors for all reflections included in the refinement: 0.132
• Goodness-of-fit parameter for all reflections included in the refinement: 1.17
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 1.54184 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No