Information card for entry 2215539

Structure parameters

• Chemical name: N-[2-(Diphenylphosphino)phenyl]benzamide
• Formula: C25 H20 N O P
• Calculated formula: C25 H20 N O P
• SMILES: P(c1c(NC(=O)c2ccccc2)cccc1)(c1ccccc1)c1ccccc1
• Title of publication: <i>N</i>-[2-(Diphenylphosphino)phenyl]benzamide
• Authors of publication: Zhang, Wen-Jie; Chen, Jian-Xin; Li, Zhong-Shui; Li, Ai-Ke; Lin, Xin-Rong
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2007
• Journal volume: 63
• Journal issue: 10
• Pages of publication: o4016 - o4016
• a: 9.936 ± 0.005 Å
• b: 10.819 ± 0.004 Å
• c: 19.038 ± 0.011 Å
• α: 90°
• β: 93.49 ± 0.02°
• γ: 90°
• Cell volume: 2042.7 ± 1.7 ų
• Cell temperature: 153 ± 2 K
• Ambient diffraction temperature: 153 ± 2 K
• Number of distinct elements: 5
• 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: 0.1082
• Residual factor for significantly intense reflections: 0.054
• Weighted residual factors for significantly intense reflections: 0.1275
• Weighted residual factors for all reflections included in the refinement: 0.152
• Goodness-of-fit parameter for all reflections included in the refinement: 1.028
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes