Information card for entry 2215328

Structure parameters

• Chemical name: <i>N</i>-Benzylidene-o-(diphenylphosphino)aniline
• Formula: C25 H20 N P
• Calculated formula: C25 H20 N P
• SMILES: P(c1c(/N=C/c2ccccc2)cccc1)(c1ccccc1)c1ccccc1
• Title of publication: <i>N</i>-Benzylidene-<i>o</i>-(diphenylphosphino)aniline
• Authors of publication: Li, Aike; Chen, Jianxin; Li, Zhongshui; Zhang, Wenjie; Zhu, Meiping
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2007
• Journal volume: 63
• Journal issue: 10
• Pages of publication: o4020 - o4020
• a: 15.076 ± 0.003 Å
• b: 6.6127 ± 0.0013 Å
• c: 20.297 ± 0.004 Å
• α: 90°
• β: 98.46 ± 0.03°
• γ: 90°
• Cell volume: 2001.5 ± 0.7 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 4
• 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: 0.0891
• Residual factor for significantly intense reflections: 0.0473
• Weighted residual factors for significantly intense reflections: 0.1325
• Weighted residual factors for all reflections included in the refinement: 0.1633
• Goodness-of-fit parameter for all reflections included in the refinement: 1.024
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes