Information card for entry 2206612

Structure parameters

• Chemical name: L-cysteine
• Formula: C3 H7 N O2 S
• Calculated formula: C3 H7 N O2 S
• SMILES: SC[C@@H](C(=O)[O-])[NH3+]
• Title of publication: <small>L</small>-Cysteine-I at 30 K
• Authors of publication: Stephen A. Moggach; Stewart J. Clark; Simon Parsons
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2005
• Journal volume: 61
• Journal issue: 8
• Pages of publication: o2739 - o2742
• a: 8.1435 ± 0.0004 Å
• b: 11.9365 ± 0.0005 Å
• c: 5.4158 ± 0.0003 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 526.44 ± 0.04 ų
• Cell temperature: 30 K
• Ambient diffraction temperature: 30 K
• Number of distinct elements: 5
• Space group number: 19
• Hermann-Mauguin space group symbol: P 21 21 21
• Hall space group symbol: P 2ac 2ab
• Residual factor for all reflections: 0.018
• Residual factor for significantly intense reflections: 0.017
• Weighted residual factors for all reflections: 0.047
• Weighted residual factors for significantly intense reflections: 0.047
• Weighted residual factors for all reflections included in the refinement: 0.047
• Goodness-of-fit parameter for all reflections included in the refinement: 1.027
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes