Information card for entry 7054861

Structure parameters

• Formula: C39 H56 Al Lu N2
• Calculated formula: C39 H56 Al Lu N2
• SMILES: c12c3ccc[n]2[Lu]24567([c]8(c1ccc3)[c]2([c]4([c]5([c]68C)C)C)C)([CH3][Al]1(CC(c2cc(cc(C(C)(C)C)c2[NH]71)C(C)(C)C)(C)C)C)C
• Title of publication: Reactivity of halfsandwich rare-earth metal methylaluminates toward potassium (2,4,6-tri-tert-butylphenyl)amide and 1-adamantylamine
• Authors of publication: Schädle, Dorothea; Enders, Markus; Schädle, Christoph; Maichle-Mössmer, Cäcilia; Törnroos, Karl W.; Anwander, Reiner
• Journal of publication: New J. Chem.
• Year of publication: 2015
• Journal volume: 39
• Journal issue: 10
• Pages of publication: 7640
• a: 12.109 ± 0.0003 Å
• b: 13.67 ± 0.0003 Å
• c: 13.7168 ± 0.0003 Å
• α: 105.191 ± 0.001°
• β: 113.695 ± 0.001°
• γ: 106.489 ± 0.001°
• Cell volume: 1801.47 ± 0.08 ų
• Cell temperature: 153 ± 2 K
• Ambient diffraction temperature: 153 ± 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: 0.022
• Residual factor for significantly intense reflections: 0.0179
• Weighted residual factors for significantly intense reflections: 0.0407
• Weighted residual factors for all reflections included in the refinement: 0.042
• Goodness-of-fit parameter for all reflections included in the refinement: 1.034
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No