Information card for entry 7704140

Structure parameters

• Formula: C77 H94 D3 N4 O3 P2
• Calculated formula: C77 H94 D3 N4 O3 P2
• Title of publication: Facile addition of E-H bonds to a dicarbondiphosphide.
• Authors of publication: Zhang, Xu; Chen, Xiaodan; Zhai, Haojiang; Liu, Shihua; Hu, Chenyang; Liu, Liu Leo; Wang, Shuhai; Li, Zhongshu
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2020
• Journal volume: 49
• Journal issue: 19
• Pages of publication: 6384 - 6390
• a: 13.3039 ± 0.0003 Å
• b: 22.5743 ± 0.0007 Å
• c: 26.5944 ± 0.0006 Å
• α: 67.479 ± 0.002°
• β: 80.235 ± 0.002°
• γ: 81.533 ± 0.002°
• Cell volume: 7241.3 ± 0.3 ų
• Cell temperature: 150 ± 0.1 K
• Ambient diffraction temperature: 150 ± 0.1 K
• Number of distinct elements: 6
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0687
• Residual factor for significantly intense reflections: 0.0531
• Weighted residual factors for significantly intense reflections: 0.1373
• Weighted residual factors for all reflections included in the refinement: 0.1498
• Goodness-of-fit parameter for all reflections included in the refinement: 1.041
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 1.54184 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No