Information card for entry 1520187

Structure parameters

• Chemical name: N-(4-methoxyphenyl)formamide
• Formula: C8 H9 N O2
• Calculated formula: C8 H9 N O2
• SMILES: c1(ccc(cc1)OC)NC=O
• Title of publication: N-(4-methoxyphenyl)formamide
• Authors of publication: Huth, Susanne L.; Threlfall, Terry L.; Hursthouse, Michael B.
• Journal of publication: Crystal Structure Report Archive
• Year of publication: 2008
• Pages of publication: 540
• a: 10.5957 ± 0.0003 Å
• b: 7.6655 ± 0.0003 Å
• c: 9.2544 ± 0.0002 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 751.65 ± 0.04 ų
• Cell temperature: 120 ± 2 K
• Ambient diffraction temperature: 120 ± 2 K
• Number of distinct elements: 4
• Space group number: 33
• Hermann-Mauguin space group symbol: P n a 21
• Hall space group symbol: P 2c -2n
• Residual factor for all reflections: 0.0313
• Residual factor for significantly intense reflections: 0.0287
• Weighted residual factors for significantly intense reflections: 0.0692
• Weighted residual factors for all reflections included in the refinement: 0.0705
• Goodness-of-fit parameter for all reflections included in the refinement: 1.053
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No