Information card for entry 2229192

Structure parameters

• Chemical name: <i>N</i>,<i>N</i>-Bis(diphenylphosphanyl)benzylamine
• Formula: C31 H27 N P2
• Calculated formula: C31 H27 N P2
• SMILES: P(N(P(c1ccccc1)c1ccccc1)Cc1ccccc1)(c1ccccc1)c1ccccc1
• Title of publication: <i>N</i>,<i>N</i>-Bis(diphenylphosphanyl)benzylamine
• Authors of publication: Liu, Xu-Feng; Xu, Wei-Hong; Li, Hui
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2011
• Journal volume: 67
• Journal issue: 2
• Pages of publication: o370
• a: 10.381 ± 0.002 Å
• b: 10.455 ± 0.002 Å
• c: 13.239 ± 0.003 Å
• α: 69.71 ± 0.03°
• β: 79.24 ± 0.03°
• γ: 70.21 ± 0.03°
• Cell volume: 1264.2 ± 0.6 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 4
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0726
• Residual factor for significantly intense reflections: 0.0588
• Weighted residual factors for significantly intense reflections: 0.1609
• Weighted residual factors for all reflections included in the refinement: 0.1733
• Goodness-of-fit parameter for all reflections included in the refinement: 1.042
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes