Information card for entry 2222817

Structure parameters

• Chemical name: <i>p</i>-Tolyl bis(<i>p</i>-tolylamido)phosphate
• Formula: C21 H23 N2 O2 P
• Calculated formula: C21 H23 N2 O2 P
• SMILES: P(=O)(Oc1ccc(cc1)C)(Nc1ccc(cc1)C)Nc1ccc(cc1)C
• Title of publication: <i>p</i>-Tolyl bis(<i>p</i>-tolylamido)phosphate
• Authors of publication: Pourayoubi, Mehrdad; Ghadimi, Saied; Ebrahimi Valmoozi, Ali Asghar; Banan, Ali Reza
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2009
• Journal volume: 65
• Journal issue: 8
• Pages of publication: o1973
• a: 14.0977 ± 0.0006 Å
• b: 14.7657 ± 0.0006 Å
• c: 9.5155 ± 0.0004 Å
• α: 90°
• β: 104.676 ± 0.001°
• γ: 90°
• Cell volume: 1916.14 ± 0.14 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 5
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/c 1
• Hall space group symbol: -P 2ybc
• Residual factor for all reflections: 0.0569
• Residual factor for significantly intense reflections: 0.0441
• Weighted residual factors for significantly intense reflections: 0.0998
• Weighted residual factors for all reflections included in the refinement: 0.1068
• Goodness-of-fit parameter for all reflections included in the refinement: 1.021
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes