Information card for entry 4088073

Structure parameters

• Formula: C22 H51 N2 Si4 Sm
• Calculated formula: C22 H51 N2 Si4 Sm
• SMILES: [Sm]123456(N([Si](C)(C)C)[Si]([CH3]1)(C)C)(N([Si](C)(C)C)[Si]([CH3]4)(C)C)[c]1([c]6([c]5([c]2([c]31C)C)C)C)C
• Title of publication: Ln(II)/Pb(II)‒Ln(III)/Pb(0) Redox Approach toward Rare-Earth-Metal Half-Sandwich Complexes
• Authors of publication: Bienfait, André M.; Wolf, Benjamin M.; Törnroos, Karl W.; Anwander, Reiner
• Journal of publication: Organometallics
• Year of publication: 2015
• Journal volume: 34
• Journal issue: 24
• Pages of publication: 5734
• a: 19.0713 ± 0.0019 Å
• b: 13.2198 ± 0.0013 Å
• c: 12.198 ± 0.0012 Å
• α: 90°
• β: 90.829 ± 0.001°
• γ: 90°
• Cell volume: 3075 ± 0.5 ų
• Cell temperature: 105 ± 2 K
• Ambient diffraction temperature: 105 ± 2 K
• Number of distinct elements: 5
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/c 1
• Hall space group symbol: -P 2ybc
• Residual factor for all reflections: 0.0325
• Residual factor for significantly intense reflections: 0.0246
• Weighted residual factors for significantly intense reflections: 0.0583
• Weighted residual factors for all reflections included in the refinement: 0.0611
• Goodness-of-fit parameter for all reflections included in the refinement: 1.039
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No