Information card for entry 2311352

Structure parameters

• Common name: cesium dihydrogen citrate
• Chemical name: cesium dihydrogen citrate
• Formula: C6 H7 Cs O7
• Calculated formula: C6 H7 Cs O7
• Title of publication: Crystal structure of caesium di-hydrogen citrate from laboratory X-ray powder diffraction data and DFT comparison.
• Authors of publication: Rammohan, Alagappa; Kaduk, James A.
• Journal of publication: Acta crystallographica. Section E, Crystallographic communications
• Year of publication: 2017
• Journal volume: 73
• Journal issue: Pt 2
• Pages of publication: 133 - 136
• a: 8.7362 ± 0.0002 Å
• b: 20.5351 ± 0.00016 Å
• c: 5.1682 ± 0.0005 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 927.17 ± 0.09 ų
• Cell temperature: 300 K
• Ambient diffraction temperature: 300 K
• Number of distinct elements: 4
• Space group number: 33
• Hermann-Mauguin space group symbol: P n a 21
• Hall space group symbol: P 2c -2n
• Goodness-of-fit parameter for all reflections: 3.43
• Method of determination: powder diffraction
• Diffraction radiation wavelength: 1.54063 Å
• Diffraction radiation type: Kα~1~
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No