Information card for entry 4087773

Structure parameters

• Formula: C35 H67 Al3 N2 Nd2
• Calculated formula: C35 H67 Al3 N2 Nd2
• SMILES: [Nd]123([N]([Nd]4(N1c1c(cccc1C(C)C)C(C)C)[CH3][Al]([CH3]4)(C)C)([Al](C)(C)C)c1c(cccc1C(C)C)C(C)C)[H]C[Al](C[H]2)(C[H]3)C
• Title of publication: Versatile Ln2(μ-NR)2-Imide Platforms for Ligand Exchange and Isoprene Polymerization
• Authors of publication: Schädle, Dorothea; Schädle, Christoph; Schneider, David; Maichle-Mössmer, Cäcilia; Anwander, Reiner
• Journal of publication: Organometallics
• Year of publication: 2015
• Journal volume: 34
• Journal issue: 20
• Pages of publication: 4994
• a: 10.0212 ± 0.0003 Å
• b: 11.0357 ± 0.0004 Å
• c: 18.7228 ± 0.0006 Å
• α: 82.426 ± 0.002°
• β: 83.762 ± 0.002°
• γ: 87.688 ± 0.002°
• Cell volume: 2039.64 ± 0.12 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 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: 0.0465
• Residual factor for significantly intense reflections: 0.0313
• Weighted residual factors for significantly intense reflections: 0.063
• Weighted residual factors for all reflections included in the refinement: 0.0675
• 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