Information card for entry 2217752

Structure parameters

• Chemical name: (E,E)-N-[3-(Biphenyl-2-ylimino)butan-2-ylidene]-2-phenylaniline
• Formula: C28 H24 N2
• Calculated formula: C28 H24 N2
• SMILES: CC(=N\c1ccccc1c1ccccc1)/C(=N/c1ccccc1c1ccccc1)C
• Title of publication: (<i>E</i>,<i>E</i>)-<i>N</i>-[3-(Biphenyl-2-ylimino)butan-2-ylidene]-2-phenylaniline
• Authors of publication: Zou, Hao; Hou, Yubang; Yong, Xuejian; Cen, Yunbin; Bao, Feng
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2008
• Journal volume: 64
• Journal issue: 3
• Pages of publication: o567
• a: 9.603 ± 0.003 Å
• b: 8.017 ± 0.003 Å
• c: 14.332 ± 0.005 Å
• α: 90°
• β: 94.74 ± 0.006°
• γ: 90°
• Cell volume: 1099.6 ± 0.7 ų
• Cell temperature: 273 ± 2 K
• Ambient diffraction temperature: 273 ± 2 K
• Number of distinct elements: 3
• 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: 0.0638
• Residual factor for significantly intense reflections: 0.0488
• Weighted residual factors for significantly intense reflections: 0.1559
• Weighted residual factors for all reflections included in the refinement: 0.1779
• Goodness-of-fit parameter for all reflections included in the refinement: 1.028
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes