Information card for entry 7704523

Structure parameters

• Formula: C50 H61 N2 O2 P Zn
• Calculated formula: C50 H61 N2 O2 P Zn
• Title of publication: Hydroboration of carbon dioxide enabled by molecular zinc dihydrides.
• Authors of publication: Wang, Xiaoming; Chang, Kejian; Xu, Xin
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2020
• Journal volume: 49
• Journal issue: 22
• Pages of publication: 7324 - 7327
• a: 21.0915 ± 0.001 Å
• b: 10.6678 ± 0.0004 Å
• c: 40.3216 ± 0.0018 Å
• α: 90°
• β: 104.462 ± 0.002°
• γ: 90°
• Cell volume: 8784.9 ± 0.7 ų
• Cell temperature: 120 ± 2 K
• Ambient diffraction temperature: 120 ± 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: 0.0653
• Residual factor for significantly intense reflections: 0.0391
• Weighted residual factors for significantly intense reflections: 0.0862
• Weighted residual factors for all reflections included in the refinement: 0.1008
• Goodness-of-fit parameter for all reflections included in the refinement: 1.071
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No