Information card for entry 2201077

Structure parameters

• Common name: N-carboxymethylaspartic acid
• Chemical name: N-carboxymethylaspartic acid
• Formula: C6 H9 N O6
• Calculated formula: C6 H9 N O6
• Title of publication: <i>N</i>-(Carboxymethyl)aspartic acid
• Authors of publication: Maderová, Jana; Pavelčík, František; Marek, Jaromír
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2002
• Journal volume: 58
• Journal issue: 4
• Pages of publication: o469 - o470
• a: 5.343 ± 0.0005 Å
• b: 16.033 ± 0.002 Å
• c: 9.0895 ± 0.0012 Å
• α: 90°
• β: 95.384 ± 0.012°
• γ: 90°
• Cell volume: 775.21 ± 0.16 ų
• Cell temperature: 120 ± 2 K
• Ambient diffraction temperature: 120 ± 2 K
• Number of distinct elements: 4
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/n 1
• Hall space group symbol: -P 2yn
• Residual factor for all reflections: 0.041
• Residual factor for significantly intense reflections: 0.033
• Weighted residual factors for significantly intense reflections: 0.079
• Weighted residual factors for all reflections included in the refinement: 0.082
• Goodness-of-fit parameter for all reflections included in the refinement: 1.09
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes