Information card for entry 2232351

Structure parameters

• Chemical name: <i>N</i>-(4-Hydroxyphenyl)-3,4,5-trimethoxybenzamide
• Formula: C16 H17 N O5
• Calculated formula: C16 H17 N O5
• SMILES: c1(cc(c(c(c1)OC)OC)OC)C(=O)Nc1ccc(cc1)O
• Title of publication: <i>N</i>-(4-Hydroxyphenyl)-3,4,5-trimethoxybenzamide
• Authors of publication: Choi, Hyeong; Shim, Yong Suk; Han, Byung Hee; Kang, Sung Kwon; Sung, Chang Keun
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2011
• Journal volume: 67
• Journal issue: 11
• Pages of publication: o2865
• a: 10.428 ± 0.0005 Å
• b: 13.4075 ± 0.0006 Å
• c: 21.5565 ± 0.0008 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 3013.9 ± 0.2 ų
• Cell temperature: 296 ± 2 K
• Ambient diffraction temperature: 296 ± 2 K
• Number of distinct elements: 4
• Space group number: 61
• Hermann-Mauguin space group symbol: P b c a
• Hall space group symbol: -P 2ac 2ab
• Residual factor for all reflections: 0.0857
• Residual factor for significantly intense reflections: 0.0542
• Weighted residual factors for all reflections included in the refinement: 0.1335
• Goodness-of-fit parameter for all reflections included in the refinement: 0.968
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes