Information card for entry 7215877

Structure parameters

• Common name: caesium D,L-hydrogen tartrate
• Formula: C4 H5 Cs O6
• Calculated formula: C4 H5 Cs O6
• Title of publication: Interplay between hydrogen bonding and metal coordination in alkali metal tartrates and hydrogen tartrates
• Authors of publication: Gelbrich, Thomas; Threlfall, Terence L.; Hursthouse, M.
• Journal of publication: CrystEngComm
• Year of publication: 2014
• a: 5.0645 ± 0.0003 Å
• b: 7.2545 ± 0.0005 Å
• c: 9.957 ± 0.0006 Å
• α: 72.369 ± 0.004°
• β: 85.46 ± 0.004°
• γ: 85.837 ± 0.003°
• Cell volume: 347.09 ± 0.04 ų
• Cell temperature: 120 ± 2 K
• Ambient diffraction temperature: 120 ± 2 K
• Number of distinct elements: 4
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0302
• Residual factor for significantly intense reflections: 0.0288
• Weighted residual factors for significantly intense reflections: 0.0696
• Weighted residual factors for all reflections included in the refinement: 0.0707
• Goodness-of-fit parameter for all reflections included in the refinement: 1.033
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No