Information card for entry 2210790

Structure parameters

• Common name: Phosphoric trianilide
• Chemical name: Trianilinophosphine oxide
• Formula: C18 H18 N3 O P
• Calculated formula: C18 H18 N3 O P
• SMILES: P(=O)(Nc1ccccc1)(Nc1ccccc1)Nc1ccccc1
• Title of publication: Trianilinophosphine oxide
• Authors of publication: Shazia Anjum; Atta-ur-Rahman; Hoong-Kun Fun
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2006
• Journal volume: 62
• Journal issue: 10
• Pages of publication: o4569 - o4571
• a: 9.9173 ± 0.0008 Å
• b: 9.2463 ± 0.0007 Å
• c: 35.405 ± 0.003 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 3246.6 ± 0.5 ų
• Cell temperature: 297 ± 2 K
• Ambient diffraction temperature: 297 ± 2 K
• Number of distinct elements: 5
• Space group number: 61
• Hermann-Mauguin space group symbol: P b c a
• Hall space group symbol: -P 2ac 2ab
• Residual factor for all reflections: 0.0554
• Residual factor for significantly intense reflections: 0.049
• Weighted residual factors for significantly intense reflections: 0.1286
• Weighted residual factors for all reflections included in the refinement: 0.1365
• Goodness-of-fit parameter for all reflections included in the refinement: 1.086
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes