Information card for entry 2221354

Structure parameters

• Chemical name: 4-[(<i>E</i>)-1-Naphthyldiazenyl]phenol
• Formula: C16 H12 N2 O
• Calculated formula: C16 H12 N2 O
• SMILES: Oc1ccc(cc1)/N=N/c1cccc2c1cccc2
• Title of publication: 4-[(<i>E</i>)-1-Naphthyldiazenyl]phenol
• Authors of publication: Aslanov, Leonid A.; Paseshnichenko, Ksenia A.; Yatsenko, Alexandr V.
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2009
• Journal volume: 65
• Journal issue: 4
• Pages of publication: o820
• a: 10.877 ± 0.003 Å
• b: 19.402 ± 0.004 Å
• c: 13.062 ± 0.004 Å
• α: 90°
• β: 107.91 ± 0.02°
• γ: 90°
• Cell volume: 2623 ± 1.2 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 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: 0.048
• Residual factor for significantly intense reflections: 0.0348
• Weighted residual factors for significantly intense reflections: 0.0807
• Weighted residual factors for all reflections included in the refinement: 0.0849
• Goodness-of-fit parameter for all reflections included in the refinement: 1.274
• Diffraction radiation wavelength: 1.54178 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes