Information card for entry 2239324

Structure parameters

• Chemical name: Diethyl [(4-nitrobenzamido)(phenyl)methyl]phosphonate
• Formula: C18 H21 N2 O6 P
• Calculated formula: C18 H21 N2 O6 P
• Title of publication: Diethyl [(4-nitrobenzamido)(phenyl)methyl]phosphonate
• Authors of publication: Chen, Jing-Wei; Li, Bai-Cun; Fang, Hua; Wu, Zhen; Fang, Mei-Juan
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2014
• Journal volume: 70
• Journal issue: 5
• Pages of publication: o548
• a: 8.112 ± 0.003 Å
• b: 10.378 ± 0.004 Å
• c: 12.583 ± 0.005 Å
• α: 106.321 ± 0.007°
• β: 90.188 ± 0.008°
• γ: 106.035 ± 0.007°
• Cell volume: 973.3 ± 0.7 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 5
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0907
• Residual factor for significantly intense reflections: 0.0754
• Weighted residual factors for significantly intense reflections: 0.1883
• Weighted residual factors for all reflections included in the refinement: 0.1995
• Goodness-of-fit parameter for all reflections included in the refinement: 1.088
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: Yes