Information card for entry 2242007

Structure parameters

• Chemical name: (<i>E</i>)-<i>N</i>^1^-[(Anthracen-9-yl)methylidene]-<i>N</i>^4^-phenylbenzene-1,4-diamine
• Formula: C27 H20 N2
• Calculated formula: C27 H20 N2
• SMILES: c12ccccc1cc1ccccc1c2/C=N/c1ccc(cc1)Nc1ccccc1
• Title of publication: Crystal structure of (<i>E</i>)-<i>N</i>^1^-[(anthracen-9-yl)methylidene]-<i>N</i>^4^-phenylbenzene-1,4-diamine
• Authors of publication: Faizi, Md. Serajul Haque; Haque, Ashanul; Ahmad, Musheer; Golenya, Irina A.
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2017
• Journal volume: 73
• Journal issue: 2
• Pages of publication: 137 - 140
• a: 11.1554 ± 0.0008 Å
• b: 45.224 ± 0.003 Å
• c: 11.5856 ± 0.0008 Å
• α: 90°
• β: 96.645 ± 0.002°
• γ: 90°
• Cell volume: 5805.6 ± 0.7 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 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: 0.0924
• Residual factor for significantly intense reflections: 0.0521
• Weighted residual factors for significantly intense reflections: 0.1057
• Weighted residual factors for all reflections included in the refinement: 0.121
• Goodness-of-fit parameter for all reflections included in the refinement: 1.037
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes