Information card for entry 2003285

Structure parameters

• Formula: C9 H12 N2 O4 S
• Calculated formula: C9 H12 N2 O4 S2
• Title of publication: 3-(5-Oxo-<small>L</small>-prolyl)-<small>L</small>-thiazolidine-4-carboxylic Acid
• Authors of publication: Ayala, D. J.; Bombieri, G.; Perosino, T.; Stradi, R.
• Journal of publication: Acta Crystallographica Section C
• Year of publication: 1995
• Journal volume: 51
• Journal issue: 3
• Pages of publication: 473 - 475
• a: 5.593 ± 0.001 Å
• b: 12.227 ± 0.002 Å
• c: 15.705 ± 0.007 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 1074 ± 0.5 ų
• Cell temperature: 298 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 significantly intense reflections: 0.0367
• Weighted residual factors for significantly intense reflections: 0.0409
• Goodness-of-fit parameter for significantly intense reflections: 0.85
• Diffraction radiation wavelength: 0.71069 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No