Information card for entry 4345669

Structure parameters

• Formula: C36 H100 O2 Si14 Sm2
• Calculated formula: C36 H100 O2 Si14 Sm2
• SMILES: C[Si](C)(C)[Si]12([Si](C)(C)C)[Sm]([O]3CCCC3)([Si]([Si]1(C)C)([Si](C)(C)C)[Si](C)(C)C)[Si]1([Si](C)(C)[Si]([Si](C)(C)C)([Si](C)(C)C)[Sm]21[O]1CCCC1)([Si](C)(C)C)[Si](C)(C)C
• Title of publication: Using Functionalized Silyl Ligands To Suppress Solvent Coordination to Silyl Lanthanide(II) Complexes.
• Authors of publication: Zitz, Rainer; Hlina, Johann; Aghazadeh Meshgi, Mohammad; Krenn, Heinz; Marschner, Christoph; Szilvási, Tibor; Baumgartner, Judith
• Journal of publication: Inorganic chemistry
• Year of publication: 2017
• a: 23.027 ± 0.005 Å
• b: 14.538 ± 0.003 Å
• c: 19.296 ± 0.004 Å
• α: 90°
• β: 102.44 ± 0.03°
• γ: 90°
• Cell volume: 6308 ± 2 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 5
• Space group number: 15
• Hermann-Mauguin space group symbol: C 1 2/c 1
• Hall space group symbol: -C 2yc
• Residual factor for all reflections: 0.0214
• Residual factor for significantly intense reflections: 0.0201
• Weighted residual factors for significantly intense reflections: 0.0496
• Weighted residual factors for all reflections included in the refinement: 0.0501
• Goodness-of-fit parameter for all reflections included in the refinement: 1.042
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No