Information card for entry 2011779

Structure parameters

• Common name: sarcosinium tartrate
• Chemical name: sarcosinium tartrate
• Formula: C7 H13 N O8
• Calculated formula: C7 H13 N O8
• SMILES: OC(=O)[C@@H](O)[C@H](O)C(=O)[O-].OC(=O)C[NH2+]C
• Title of publication: Sarcosinium tartrate
• Authors of publication: Krishnakumar, R. V.; Subha Nandhini, M.; Natarajan, S.
• Journal of publication: Acta Crystallographica Section C
• Year of publication: 2001
• Journal volume: 57
• Journal issue: 2
• Pages of publication: 165 - 166
• a: 5.0038 ± 0.0015 Å
• b: 6.442 ± 0.002 Å
• c: 8.3179 ± 0.0011 Å
• α: 78.6 ± 0.02°
• β: 80.62 ± 0.02°
• γ: 79.8 ± 0.02°
• Cell volume: 256.39 ± 0.12 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 4
• Space group number: 1
• Hermann-Mauguin space group symbol: P 1
• Hall space group symbol: P 1
• Residual factor for all reflections: 0.025
• Residual factor for significantly intense reflections: 0.025
• Weighted residual factors for all reflections included in the refinement: 0.066
• Goodness-of-fit parameter for all reflections included in the refinement: 1.089
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: Mokα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No