Information card for entry 4074384

Structure parameters

• Formula: C9 H28 B P Si2
• Calculated formula: C9 H28 B P Si2
• SMILES: [P]([BH3])(C([Si](C)(C)C)[Si](C)(C)C)(C)C
• Title of publication: Heavier Alkali Metal Complexes of a Silicon- and Phosphine-Borane-Stabilized Carbanion
• Authors of publication: Izod, Keith; Wills, Corinne; Clegg, William; Harrington, Ross W.
• Journal of publication: Organometallics
• Year of publication: 2006
• Journal volume: 25
• Journal issue: 22
• Pages of publication: 5326
• a: 8.7346 ± 0.0006 Å
• b: 14.7363 ± 0.001 Å
• c: 12.2135 ± 0.0008 Å
• α: 90°
• β: 106.193 ± 0.001°
• γ: 90°
• Cell volume: 1509.7 ± 0.18 ų
• Cell temperature: 120 ± 2 K
• Ambient diffraction temperature: 120 ± 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: 0.0476
• Residual factor for significantly intense reflections: 0.0366
• Weighted residual factors for significantly intense reflections: 0.0996
• Weighted residual factors for all reflections included in the refinement: 0.1064
• Goodness-of-fit parameter for all reflections included in the refinement: 1.038
• Diffraction radiation wavelength: 0.6709 Å
• Diffraction radiation type: synchrotron
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No