Information card for entry 2242660

Structure parameters

• Chemical name: (<i>E</i>)-<i>N</i>-[(2-Ethoxynaphthalen-1-yl)methylidene]-5,6,7,8-tetrahydronaphthalen-1-amine
• Formula: C23 H23 N O
• Calculated formula: C23 H23 N O
• SMILES: c1(c(ccc2ccccc12)OCC)/C=N/c1cccc2CCCCc12
• Title of publication: Crystal structure and Hirshfeld surface analysis of (<i>E</i>)-<i>N</i>-[(2-ethoxynaphthalen-1-yl)methylidene]-5,6,7,8-tetrahydronaphthalen-1-amine
• Authors of publication: Kansiz, Sevgi; Macit, Mustafa; Dege, Necmi; Tsapyuk, Galyna G.
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2018
• Journal volume: 74
• Journal issue: 10
• Pages of publication: 1513 - 1516
• a: 12.6628 ± 0.0004 Å
• b: 20.3304 ± 0.0009 Å
• c: 7.3838 ± 0.0003 Å
• α: 90°
• β: 104.895 ± 0.003°
• γ: 90°
• Cell volume: 1837.01 ± 0.13 ų
• Cell temperature: 296 ± 2 K
• Ambient diffraction temperature: 296 ± 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: 0.1166
• Residual factor for significantly intense reflections: 0.0805
• Weighted residual factors for significantly intense reflections: 0.2271
• Weighted residual factors for all reflections included in the refinement: 0.2554
• Goodness-of-fit parameter for all reflections included in the refinement: 1.044
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes