Information card for entry 4060259

Structure parameters

• Formula: C46 H88 B20 Li N2 O5 P2 Y
• Calculated formula: C46 H88 B20 Li N2 O5 P2 Y
• Journal of publication: Organometallics
• Year of publication: 2004
• a: 14.0158 ± 0.0008 Å
• b: 13.6431 ± 0.0008 Å
• c: 33.688 ± 0.002 Å
• α: 90°
• β: 99.643 ± 0.001°
• γ: 90°
• Cell volume: 6350.8 ± 0.6 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 8
• 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: 0.0576
• Residual factor for significantly intense reflections: 0.0394
• Weighted residual factors for significantly intense reflections: 0.1032
• Weighted residual factors for all reflections included in the refinement: 0.1089
• Goodness-of-fit parameter for all reflections included in the refinement: 0.98
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No