Information card for entry 2210993

Structure parameters

• Common name: Hydroxy-diphenyl-acetic acid 1-methyl-piperidin-4-yl ester
• Chemical name: 1-Methylpiperidin-4-yl hydroxydiphenylacetate
• Formula: C20 H23 N O3
• Calculated formula: C20 H23 N O3
• SMILES: OC(C(=O)OC1CCN(CC1)C)(c1ccccc1)c1ccccc1
• Title of publication: 1-Methylpiperidin-4-yl hydroxydiphenylacetate
• Authors of publication: Fu, De-Cai; Sun, Feng-Xia; Liu, Qian; Lv, Hai-Jun
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2006
• Journal volume: 62
• Journal issue: 11
• Pages of publication: o5284 - o5285
• a: 15.3791 ± 0.0017 Å
• b: 13.2941 ± 0.0014 Å
• c: 17.0078 ± 0.0019 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 3477.3 ± 0.7 ų
• Cell temperature: 113 ± 2 K
• Ambient diffraction temperature: 113 ± 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: 0.0532
• Residual factor for significantly intense reflections: 0.0428
• Weighted residual factors for significantly intense reflections: 0.1024
• Weighted residual factors for all reflections included in the refinement: 0.1088
• Goodness-of-fit parameter for all reflections included in the refinement: 1.096
• Diffraction radiation wavelength: 0.7107 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes