Information card for entry 2004938

Structure parameters

• Chemical name: N,N-dibenzoyl-2-phenylbenzylamine
• Formula: C27 H21 N O2
• Calculated formula: C27 H21 N O2
• SMILES: N(Cc1c(cccc1)c1ccccc1)(C(=O)c1ccccc1)C(=O)c1ccccc1
• Title of publication: <i>N</i>,<i>N</i>-Dibenzoyl-2-phenylbenzylamine
• Authors of publication: Blake, A. J.; Cullen, K. E.; Sharp, J. T.
• Journal of publication: Acta Crystallographica Section C
• Year of publication: 1996
• Journal volume: 52
• Journal issue: 6
• Pages of publication: 1546 - 1548
• a: 14.8208 ± 0.0012 Å
• b: 8.1939 ± 0.0004 Å
• c: 17.4844 ± 0.0009 Å
• α: 90°
• β: 91.185 ± 0.004°
• γ: 90°
• Cell volume: 2122.9 ± 0.2 ų
• Cell temperature: 298 ± 2 K
• Ambient diffraction temperature: 298 ± 2 K
• Number of distinct elements: 4
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/n 1
• Hall space group symbol: -P 2yn
• Residual factor for all reflections: 0.0558
• Residual factor for significantly intense reflections: 0.0347
• Weighted residual factors for all reflections: 0.1044
• Weighted residual factors for significantly intense reflections: 0.0936
• Goodness-of-fit parameter for all reflections: 1.034
• Goodness-of-fit parameter for significantly intense reflections: 1.086
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No