Information card for entry 2232329

Structure parameters

• Common name: 2-(2-Methoxyphenoxy)pyrazine
• Chemical name: 2-(2-Methoxyphenoxy)pyrazine
• Formula: C11 H10 N2 O2
• Calculated formula: C11 H10 N2 O2
• SMILES: O(c1nccnc1)c1ccccc1OC
• Title of publication: 2-(2-Methoxyphenoxy)pyrazine
• Authors of publication: Nasir, Shah Bakhtiar; Fairuz, Zainal Abidin; Abdullah, Zanariah; Ng, Seik Weng; Tiekink, Edward R. T.
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2011
• Journal volume: 67
• Journal issue: 11
• Pages of publication: o3088
• a: 7.7497 ± 0.001 Å
• b: 5.8826 ± 0.0008 Å
• c: 21.845 ± 0.003 Å
• α: 90°
• β: 92.459 ± 0.002°
• γ: 90°
• Cell volume: 995 ± 0.2 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/n 1
• Hall space group symbol: -P 2yn
• Residual factor for all reflections: 0.0577
• Residual factor for significantly intense reflections: 0.0388
• Weighted residual factors for significantly intense reflections: 0.0953
• Weighted residual factors for all reflections included in the refinement: 0.1074
• Goodness-of-fit parameter for all reflections included in the refinement: 1.032
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes