Information card for entry 2208911

Structure parameters

• Chemical name: 2-(1-Naphthyliminomethyl)phenol
• Formula: C17 H13 N O
• Calculated formula: C17 H13 N O
• SMILES: Oc1c(/C=N/c2cccc3ccccc23)cccc1
• Title of publication: 2-(1-Naphthyliminomethyl)phenol
• Authors of publication: Cheng, Kui; Zhu, Hai-Liang; Liu, Jing-Jing; Gao, Meng; Zeng, Jun-He
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2006
• Journal volume: 62
• Journal issue: 5
• Pages of publication: o1932 - o1933
• a: 10.582 ± 0.0007 Å
• b: 12.5388 ± 0.0009 Å
• c: 19.425 ± 0.0013 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 2577.4 ± 0.3 ų
• Cell temperature: 292 ± 2 K
• Ambient diffraction temperature: 292 ± 2 K
• Number of distinct elements: 4
• Space group number: 61
• Hermann-Mauguin space group symbol: P b c a
• Hall space group symbol: -P 2ac 2ab
• Residual factor for all reflections: 0.0564
• Residual factor for significantly intense reflections: 0.0459
• Weighted residual factors for significantly intense reflections: 0.1234
• Weighted residual factors for all reflections included in the refinement: 0.1303
• Goodness-of-fit parameter for all reflections included in the refinement: 1.041
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes