Information card for entry 4087776

Structure parameters

• Formula: C51 H85 Al La2 N2 Si2
• Calculated formula: C51 H85 Al La2 N2 Si2
• SMILES: [La]123456([N]7(c8c(cccc8C(C)C)C(C)C)[La]89%10%11(N1c1c(C(C)C)cccc1C(C)C)([CH3][Al]7([CH3]2)C)[c]1([c]%10([c]%11([c]8([c]91C)C)C)C)[Si](C)(C)C)[c]1([Si](C)(C)C)[c]4([c]5([c]6([c]31C)C)C)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: 12.7087 ± 0.0011 Å
• b: 13.307 ± 0.0013 Å
• c: 16.9413 ± 0.0014 Å
• α: 102.936 ± 0.002°
• β: 92.217 ± 0.002°
• γ: 107.517 ± 0.002°
• Cell volume: 2645.4 ± 0.4 ų
• Cell temperature: 109 ± 2 K
• Ambient diffraction temperature: 109 ± 2 K
• Number of distinct elements: 6
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0512
• Residual factor for significantly intense reflections: 0.036
• Weighted residual factors for significantly intense reflections: 0.0716
• Weighted residual factors for all reflections included in the refinement: 0.0772
• Goodness-of-fit parameter for all reflections included in the refinement: 1.061
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No