Information card for entry 1543872

Structure parameters

• Common name: L-methionine
• Chemical name: S-2-amino-4-(methylthio)butanoic acid
• Formula: C5 H11 N O2 S
• Calculated formula: C4.998 H10.996 N O2 S0.9995
• Title of publication: An exceptional series of phase transitions in hydrophobic amino acids with linear side chains
• Authors of publication: Görbitz, Carl Henrik; Karen, Pavel; Dušek, Michal; Petříček, Václav
• Journal of publication: IUCrJ
• Year of publication: 2016
• Journal volume: 3
• Journal issue: 5
• a: 9.5118 ± 0.0006 Å
• b: 5.1936 ± 0.0004 Å
• c: 15.3419 ± 0.001 Å
• α: 90°
• β: 97.635 ± 0.002°
• γ: 90°
• Cell volume: 751.18 ± 0.09 ų
• Cell temperature: 289 ± 2 K
• Ambient diffraction temperature: 289 ± 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: 0.0625
• Residual factor for significantly intense reflections: 0.0466
• Weighted residual factors for significantly intense reflections: 0.1098
• Weighted residual factors for all reflections included in the refinement: 0.1179
• Goodness-of-fit parameter for all reflections included in the refinement: 1.046
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No