Information card for entry 2224476

Structure parameters

• Chemical name: L-Serine methyl ester hydrochloride
• Formula: C4 H10 Cl N O3
• Calculated formula: C4 H10 Cl N O3
• SMILES: O(C(=O)[C@@H]([NH3+])CO)C.[Cl-]
• Title of publication: <small>L</small>-Serine methyl ester hydrochloride
• Authors of publication: Schouten, Arie; Lutz, Martin
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2009
• Journal volume: 65
• Journal issue: 12
• Pages of publication: o3026
• a: 5.22645 ± 0.00009 Å
• b: 6.39388 ± 0.00014 Å
• c: 11.642 ± 0.0004 Å
• α: 90°
• β: 90.09 ± 0.001°
• γ: 90°
• Cell volume: 389.044 ± 0.017 ų
• Cell temperature: 150 ± 2 K
• Ambient diffraction temperature: 150 ± 2 K
• Number of distinct elements: 5
• Space group number: 4
• Hermann-Mauguin space group symbol: P 1 21 1
• Hall space group symbol: P 2yb
• Residual factor for all reflections: 0.0254
• Residual factor for significantly intense reflections: 0.0223
• Weighted residual factors for significantly intense reflections: 0.0565
• Weighted residual factors for all reflections included in the refinement: 0.0583
• Goodness-of-fit parameter for all reflections included in the refinement: 1.066
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes