Information card for entry 4060260

Structure parameters

• Formula: C62 H130 B20 Cl5 Er2 Li3 N2 O14 P2
• Calculated formula: C62 H131 B20 Cl5 Er2 Li3 N2 O14 P2
• Journal of publication: Organometallics
• Year of publication: 2004
• a: 21.6048 ± 0.001 Å
• b: 13.9327 ± 0.0006 Å
• c: 32.94 ± 0.0015 Å
• α: 90°
• β: 103.21 ± 0.001°
• γ: 90°
• Cell volume: 9653 ± 0.8 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 9
• 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: 0.0947
• Residual factor for significantly intense reflections: 0.0727
• Weighted residual factors for significantly intense reflections: 0.1918
• Weighted residual factors for all reflections included in the refinement: 0.2231
• Goodness-of-fit parameter for all reflections included in the refinement: 1.087
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No