Information card for entry 4060145

Structure parameters

• Formula: C36 H62 B Mg N3 O
• Calculated formula: C36 H62 B Mg N3 O
• Journal of publication: Organometallics
• Year of publication: 2005
• a: 11.099 ± 0.002 Å
• b: 18.001 ± 0.003 Å
• c: 18.638 ± 0.003 Å
• α: 90°
• β: 101.81 ± 0.007°
• γ: 90°
• Cell volume: 3644.9 ± 1.1 ų
• Cell temperature: 173 ± 2 K
• Ambient diffraction temperature: 173 ± 2 K
• Number of distinct elements: 6
• 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: 0.0831
• Residual factor for significantly intense reflections: 0.0518
• Weighted residual factors for significantly intense reflections: 0.1326
• Weighted residual factors for all reflections included in the refinement: 0.1539
• Goodness-of-fit parameter for all reflections included in the refinement: 1.013
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No