Information card for entry 7104062

Structure parameters

• Formula: C81 H171 Li6 P8 Si6
• Calculated formula: C81 H171 Li6 P8 Si6
• Title of publication: A Novel Type of Phosphide: Synthesis and X-ray Crystal Structure Analysis of (tBu~3~Si)~3~P~4~Li~3~
• Authors of publication: Lerner, Hans-Wolfram; Wagner, Matthias; Bolte, Michael
• Journal of publication: Chemical communications (Cambridge, United Kingdom)
• Year of publication: 2003
• Journal issue: 8
• Pages of publication: 990 - 991
• a: 22.146 ± 0.004 Å
• b: 17.6 ± 0.002 Å
• c: 27.087 ± 0.007 Å
• α: 90°
• β: 90.046 ± 0.017°
• γ: 90°
• Cell volume: 10558 ± 4 ų
• Ambient diffraction temperature: 173 ± 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: 0.278
• Residual factor for significantly intense reflections: 0.0981
• Weighted residual factors for significantly intense reflections: 0.1605
• Weighted residual factors for all reflections included in the refinement: 0.2338
• Goodness-of-fit parameter for all reflections included in the refinement: 0.755
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No