Information card for entry 4075356

Structure parameters

• Common name: (BDPPthf)La(AlMe4)(AlMe3)
• Formula: C37 H65 Al2 La N2 O
• Calculated formula: C37 H65 Al2 La N2 O
• SMILES: [La]1234([CH3][Al]([CH3]4)(C)C)[CH3][Al]([N]3(C[C@@H]3[O]1[C@H](CN2c1c(cccc1C(C)C)C(C)C)CC3)c1c(cccc1C(C)C)C(C)C)(C)C.[La]1234([CH3][Al]([CH3]4)(C)C)[CH3][Al]([N]3(C[C@H]3[O]1[C@@H](CN2c1c(cccc1C(C)C)C(C)C)CC3)c1c(cccc1C(C)C)C(C)C)(C)C
• Title of publication: Implementation of Ln(AlMe4)3as Precursors in Postlanthanidocene Chemistry
• Authors of publication: Zimmermann, Melanie; Törnroos, Karl W.; Anwander, Reiner
• Journal of publication: Organometallics
• Year of publication: 2006
• Journal volume: 25
• Journal issue: 15
• Pages of publication: 3593
• a: 9.5128 ± 0.0007 Å
• b: 10.8146 ± 0.0008 Å
• c: 40.644 ± 0.003 Å
• α: 90°
• β: 93.035 ± 0.001°
• γ: 90°
• Cell volume: 4175.5 ± 0.5 ų
• Cell temperature: 153 ± 2 K
• Ambient diffraction temperature: 153 ± 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: 0.0373
• Residual factor for significantly intense reflections: 0.0297
• Weighted residual factors for significantly intense reflections: 0.0672
• Weighted residual factors for all reflections included in the refinement: 0.0691
• Goodness-of-fit parameter for all reflections included in the refinement: 1.075
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No