Information card for entry 4122148

Structure parameters

• Formula: C51 H83 Li O6 P
• Calculated formula: C51 H83 Li O6 P
• Title of publication: A crystalline phosphaalkene radical anion.
• Authors of publication: Pan, Xiaobo; Wang, Xingyong; Zhao, Yue; Sui, Yunxia; Wang, Xinping
• Journal of publication: Journal of the American Chemical Society
• Year of publication: 2014
• Journal volume: 136
• Journal issue: 28
• Pages of publication: 9834 - 9837
• a: 11.2419 ± 0.0012 Å
• b: 11.434 ± 0.0012 Å
• c: 20.378 ± 0.002 Å
• α: 88.275 ± 0.001°
• β: 89.862 ± 0.002°
• γ: 76.552 ± 0.002°
• Cell volume: 2546.4 ± 0.5 ų
• Cell temperature: 123 ± 2 K
• Ambient diffraction temperature: 123 ± 2 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: 0.0543
• Residual factor for significantly intense reflections: 0.0478
• Weighted residual factors for significantly intense reflections: 0.111
• Weighted residual factors for all reflections included in the refinement: 0.1328
• Goodness-of-fit parameter for all reflections included in the refinement: 1.199
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No