Information card for entry 7243134

Structure parameters

• Common name: GABA-L-tartaric acid (1:1) monohydrate
• Chemical name: GABA-L-tartaric acid (1:1) monohydrate
• Formula: C8 H17 N O9
• Calculated formula: C8 H17 N O9
• Title of publication: A new monohydrated molecular salt of GABA with l-tartaric acid: the structure-forming role of water
• Authors of publication: Losev, E. A.; Pishchur, D. P.; Boldyreva, E. V.
• Journal of publication: CrystEngComm
• Year of publication: 2021
• Journal volume: 23
• Journal issue: 35
• Pages of publication: 6086 - 6092
• a: 6.1846 ± 0.0002 Å
• b: 27.8403 ± 0.0008 Å
• c: 7.4558 ± 0.0002 Å
• α: 90°
• β: 109.007 ± 0.003°
• γ: 90°
• Cell volume: 1213.76 ± 0.07 ų
• Cell temperature: 293 K
• Ambient diffraction temperature: 293 K
• Number of distinct elements: 4
• Space group number: 4
• Hermann-Mauguin space group symbol: P 1 21 1
• Hall space group symbol: P 2yb
• Residual factor for all reflections: 0.0629
• Residual factor for significantly intense reflections: 0.0477
• Weighted residual factors for significantly intense reflections: 0.0937
• Weighted residual factors for all reflections included in the refinement: 0.1002
• Goodness-of-fit parameter for all reflections included in the refinement: 1.024
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No