Information card for entry 2311332

Structure parameters

• Common name: sodium dipotassium citrate
• Chemical name: Sodium dipotassium citrate
• Formula: C6 H5 K2 Na O7
• Calculated formula: C6 H5 K2 Na O7
• SMILES: [K+].OC(CC([O-])=O)(CC(=O)[O-])C(=O)[O-].[Na+].[K+]
• Title of publication: Sodium dipotassium citrate, NaK2C6H5O7.
• Authors of publication: Rammohan, Alagappa; Kaduk, James A.
• Journal of publication: Acta crystallographica. Section E, Crystallographic communications
• Year of publication: 2016
• Journal volume: 72
• Journal issue: Pt 3
• Pages of publication: 403 - 406
• a: 5.51284 ± 0.00012 Å
• b: 7.62583 ± 0.00013 Å
• c: 11.37121 ± 0.00014 Å
• α: 83.4276 ± 0.0017°
• β: 88.991 ± 0.002°
• γ: 84.3488 ± 0.0016°
• Cell volume: 472.586 ± 0.014 ų
• Cell temperature: 300 K
• Ambient diffraction temperature: 300 K
• Number of distinct elements: 5
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Goodness-of-fit parameter for all reflections: 1.75
• 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