Information card for entry 2203515

Structure parameters

• Chemical name: potassium calcium flurine-carbonate
• Formula: C Ca F K O3
• Calculated formula: C Ca F K O3
• SMILES: [Ca+2].[F-].[O-]C(=O)[O-].[K+]
• Title of publication: KCaF(CO~3~), from X-ray Powder Data
• Authors of publication: Chen, Xiaolong; He, Meng; Xu, Yanping; Li Heqing; Tu Qingyun
• Journal of publication: Acta Crystallographica, Section E
• Year of publication: 2004
• Journal volume: 60
• Journal issue: 4
• Pages of publication: i50 - i51
• a: 5.10093 ± 0.00007 Å
• b: 5.10093 ± 0.00007 Å
• c: 4.4551 ± 0.00007 Å
• α: 90°
• β: 90°
• γ: 120°
• Cell volume: 100.389 ± 0.005 ų
• Cell temperature: 295 K
• Ambient diffraction temperature: 295 K
• Number of distinct elements: 5
• Space group number: 187
• Hermann-Mauguin space group symbol: P -6 m 2
• Hall space group symbol: P -6 2
• Goodness-of-fit parameter for all reflections: 2.26
• Diffraction radiation wavelength: 1.54056 Å
• Diffraction radiation type: CuKα~1~
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No