Information card for entry 4089650

Structure parameters

• Formula: C12 H38 B2 P2 Si2
• Calculated formula: C12 H38 B2 P2 Si2
• SMILES: C[P](C[Si](CC[Si](C[P]([BH3])(C)C)(C)C)(C)C)([BH3])C
• Title of publication: Synthesis and Structural Characterization of Phosphine‒Borane-Stabilized Dicarbanions with either Rigid or Flexible Spacers
• Authors of publication: Izod, Keith; Dixon, Casey M.; McMeekin, Emma; Rodgers, Lee; Harrington, Ross W.; Baisch, Ulrich
• Journal of publication: Organometallics
• Year of publication: 2013
• Journal volume: 33
• Journal issue: 1
• Pages of publication: 378
• a: 6.1097 ± 0.0007 Å
• b: 6.3338 ± 0.0009 Å
• c: 15.3651 ± 0.0014 Å
• α: 93.414 ± 0.009°
• β: 90.514 ± 0.008°
• γ: 117.629 ± 0.013°
• Cell volume: 525.41 ± 0.12 ų
• Cell temperature: 150.15 K
• Ambient diffraction temperature: 150.15 K
• Number of distinct elements: 5
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0416
• Residual factor for significantly intense reflections: 0.0356
• Weighted residual factors for significantly intense reflections: 0.0885
• Weighted residual factors for all reflections included in the refinement: 0.0927
• Goodness-of-fit parameter for all reflections included in the refinement: 1.074
• Diffraction radiation wavelength: 1.5418 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No