Information card for entry 2214477

Structure parameters

• Chemical name: (6E,7E)-N,N'-Bis(2-hydroxy-3-methoxybenzylidene)benzene-1,4-diamine
• Formula: C22 H20 N2
• Calculated formula: C22 H20 N2
• SMILES: CC(=N\c1ccc(cc1)/N=C(/c1ccccc1)C)/c1ccccc1
• Title of publication: (6<i>E</i>,7<i>E</i>)-<i>N</i>,<i>N</i>'-Bis(2-hydroxy-3-methoxybenzylidene)benzene-1,4-diamine
• Authors of publication: Liu, Y.-F.; Xia, H.-T.; Yang, S.-P.; Wang, D.-Q.
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2007
• Journal volume: 63
• Journal issue: 8
• Pages of publication: o3560 - o3560
• a: 5.9718 ± 0.0011 Å
• b: 6.8701 ± 0.0015 Å
• c: 21.713 ± 0.002 Å
• α: 90°
• β: 90.72 ± 0.002°
• γ: 90°
• Cell volume: 890.7 ± 0.3 ų
• Cell temperature: 298 ± 2 K
• Ambient diffraction temperature: 298 ± 2 K
• Number of distinct elements: 3
• 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: 0.0972
• Residual factor for significantly intense reflections: 0.0509
• Weighted residual factors for significantly intense reflections: 0.1167
• Weighted residual factors for all reflections included in the refinement: 0.1441
• Goodness-of-fit parameter for all reflections included in the refinement: 1.02
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes