Information card for entry 7704428

Structure parameters

• Formula: C13 H33 Al O Si2
• Calculated formula: C13 H33 Al O Si2
• Title of publication: Scandium bis(trimethylsilyl)methyl complexes revisited: extending the ⁴⁵Sc NMR chemical shift range and a new structural motif of Li[CH(SiMe₃)₂].
• Authors of publication: Mortis, Alexandros; Barisic, Damir; Eichele, Klaus; Maichle-Mössmer, Cäcilia; Anwander, Reiner
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2020
• Journal volume: 49
• Journal issue: 23
• Pages of publication: 7829 - 7841
• a: 16.5825 ± 0.0012 Å
• b: 7.2695 ± 0.0005 Å
• c: 16.6064 ± 0.0011 Å
• α: 90°
• β: 109.608 ± 0.001°
• γ: 90°
• Cell volume: 1885.8 ± 0.2 ų
• Cell temperature: 102 ± 2 K
• Ambient diffraction temperature: 102 ± 2 K
• Number of distinct elements: 5
• 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: 0.0485
• Residual factor for significantly intense reflections: 0.0347
• Weighted residual factors for significantly intense reflections: 0.0819
• Weighted residual factors for all reflections included in the refinement: 0.0882
• Goodness-of-fit parameter for all reflections included in the refinement: 1.05
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No