Information card for entry 4333708

Structure parameters

• Formula: C22 H50 B K N3 P Si2
• Calculated formula: C22 H50 B K N3 P Si2
• SMILES: [BH3]P(C([Si](C)(C)C)[Si](C)(C)C)c1ccccc1.[K]12[N](C)(C)CC[N]1(C)CC[N]2(C)C
• Title of publication: Phosphido-Borane and Phosphido-Bis(Borane) Complexes of the Alkali Metals, a Comparative Study
• Authors of publication: Keith Izod; James M. Watson; William Clegg; Ross W. Harrington
• Journal of publication: Inorganic Chemistry
• Year of publication: 2013
• Journal volume: 52
• Pages of publication: 1466 - 1475
• a: 9.8704 ± 0.0007 Å
• b: 13.1887 ± 0.001 Å
• c: 13.5125 ± 0.001 Å
• α: 105.817 ± 0.007°
• β: 107.826 ± 0.006°
• γ: 100.218 ± 0.007°
• Cell volume: 1544.5 ± 0.2 ų
• Cell temperature: 150 ± 2 K
• Ambient diffraction temperature: 150 ± 2 K
• Number of distinct elements: 7
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0661
• Residual factor for significantly intense reflections: 0.0533
• Weighted residual factors for significantly intense reflections: 0.1344
• Weighted residual factors for all reflections included in the refinement: 0.1498
• Goodness-of-fit parameter for all reflections included in the refinement: 1.071
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No