Information card for entry 2220114

Structure parameters

• Chemical name: Tetraethylammonium L-tartarate dihydrate
• Formula: C12 H29 N O8
• Calculated formula: C12 H29 N O8
• SMILES: O=C(O)[C@@H](O)[C@H](O)C(=O)[O-].[N+](CC)(CC)(CC)CC.O.O
• Title of publication: Tetraethylammonium <small>L</small>-tartarate dihydrate
• Authors of publication: Rahman, Mohd Basyaruddin Abdul; Jumbri, Khairulazhar; Sirat, Kamaliah; Kia, Reza; Fun, Hoong-Kun
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2008
• Journal volume: 64
• Journal issue: 12
• Pages of publication: o2343
• a: 7.4074 ± 0.0001 Å
• b: 13.8989 ± 0.0002 Å
• c: 8.0546 ± 0.0001 Å
• α: 90°
• β: 106.553 ± 0.001°
• γ: 90°
• Cell volume: 794.892 ± 0.019 ų
• Cell temperature: 100 ± 0.1 K
• Ambient diffraction temperature: 100 ± 0.1 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: 0.0426
• Residual factor for significantly intense reflections: 0.0371
• Weighted residual factors for significantly intense reflections: 0.0886
• Weighted residual factors for all reflections included in the refinement: 0.0922
• Goodness-of-fit parameter for all reflections included in the refinement: 1.049
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes