Information card for entry 2221522

Structure parameters

• Chemical name: 1-Naphthyl quinoxalin-2-yl ether
• Formula: C18 H12 N2 O
• Calculated formula: C18 H12 N2 O
• SMILES: O(c1cccc2ccccc12)c1nc2c(nc1)cccc2
• Title of publication: 1-Naphthyl quinoxalin-2-yl ether
• Authors of publication: Hassan, Noor Doha; Tajuddin, Hairul Anuar; Abdullah, Zanariah; Ng, Seik Weng
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2009
• Journal volume: 65
• Journal issue: 4
• Pages of publication: o731
• a: 18.2758 ± 0.0006 Å
• b: 18.5123 ± 0.0006 Å
• c: 7.7947 ± 0.0003 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 2637.16 ± 0.16 ų
• Cell temperature: 118 ± 2 K
• Ambient diffraction temperature: 118 ± 2 K
• Number of distinct elements: 4
• Space group number: 41
• Hermann-Mauguin space group symbol: A b a 2
• Hall space group symbol: A 2 -2ab
• Residual factor for all reflections: 0.055
• Residual factor for significantly intense reflections: 0.038
• Weighted residual factors for significantly intense reflections: 0.079
• Weighted residual factors for all reflections included in the refinement: 0.087
• 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