Information card for entry 4072515

Structure parameters

• Formula: C13 H27 B4 Er Si
• Calculated formula: C13 H27 B4 Er Si
• Title of publication: Chemistry of C-Trimethylsilyl-Substituted Heterocarboranes. 33. Synthesis of Mixed-Ligand Metallacarboranes of Yttrium and Lanthanides Derived from Open η5-Pentadiene and C2B4-Carborane: A Synthetic and Structural Investigation
• Authors of publication: Wang, Jianhui; Zheng, Chong; Canseco-Melchor, Graciela; Hilby, Daniel J.; Maguire, John A.; Hosmane, Narayan S.
• Journal of publication: Organometallics
• Year of publication: 2007
• Journal volume: 26
• Journal issue: 3
• Pages of publication: 577
• a: 18.164 ± 0.003 Å
• b: 12.869 ± 0.002 Å
• c: 16.553 ± 0.003 Å
• α: 90°
• β: 110.61 ± 0.003°
• γ: 90°
• Cell volume: 3621.7 ± 1.1 ų
• Cell temperature: 203 ± 2 K
• Ambient diffraction temperature: 203 ± 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: 0.0484
• Residual factor for significantly intense reflections: 0.0471
• Weighted residual factors for significantly intense reflections: 0.128
• Weighted residual factors for all reflections included in the refinement: 0.1292
• Goodness-of-fit parameter for all reflections included in the refinement: 1.167
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No