Information card for entry 2231197

Structure parameters

• Chemical name: Phenyl bis(<i>m</i>-tolylamido)phosphinate
• Formula: C20 H21 N2 O2 P
• Calculated formula: C20 H21 N2 O2 P
• SMILES: P(=O)(Oc1ccccc1)(Nc1cc(ccc1)C)Nc1cc(ccc1)C
• Title of publication: Phenyl bis(<i>m</i>-tolylamido)phosphinate
• Authors of publication: Pourayoubi, Mehrdad; Eshtiagh-Hosseini, Hossein; Negari, Monireh; Nečas, Marek
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2011
• Journal volume: 67
• Journal issue: 8
• Pages of publication: o1870
• a: 10.193 ± 0.0002 Å
• b: 16.8789 ± 0.0003 Å
• c: 10.4588 ± 0.0003 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 1799.4 ± 0.07 ų
• Cell temperature: 120 ± 2 K
• Ambient diffraction temperature: 120 ± 2 K
• Number of distinct elements: 5
• Space group number: 33
• Hermann-Mauguin space group symbol: P n a 21
• Hall space group symbol: P 2c -2n
• Residual factor for all reflections: 0.0236
• Residual factor for significantly intense reflections: 0.0218
• Weighted residual factors for significantly intense reflections: 0.0614
• Weighted residual factors for all reflections included in the refinement: 0.062
• Goodness-of-fit parameter for all reflections included in the refinement: 1.051
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes