Information card for entry 2226688

Structure parameters

• Chemical name: 2-Ethoxy-6-[(methylimino)methyl]phenol
• Formula: C10 H13 N O2
• Calculated formula: C10 H13 N O2
• SMILES: c1(c(cccc1OCC)C=NC)O
• Title of publication: 2-Ethoxy-6-[(methylimino)methyl]phenol
• Authors of publication: Ge, Cheng Min; Zhang, Shu-Hua; Chao, Feng; Wang, Yin Guang; Li, Wei
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2010
• Journal volume: 66
• Journal issue: 7
• Pages of publication: o1526
• a: 9.2986 ± 0.0019 Å
• b: 14.713 ± 0.003 Å
• c: 7.0551 ± 0.0015 Å
• α: 90°
• β: 108.465 ± 0.008°
• γ: 90°
• Cell volume: 915.5 ± 0.3 ų
• Cell temperature: 296 ± 2 K
• Ambient diffraction temperature: 296 ± 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: 0.0939
• Residual factor for significantly intense reflections: 0.0848
• Weighted residual factors for significantly intense reflections: 0.2642
• Weighted residual factors for all reflections included in the refinement: 0.2772
• Goodness-of-fit parameter for all reflections included in the refinement: 1.01
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes