Information card for entry 2105721

Structure parameters

• Formula: C2 Ba F6 O6 S2
• Calculated formula: C2 Ba F6 O6 S2
• SMILES: [Ba+2].[O-]S(=O)(=O)C(F)(F)F.[O-]S(=O)(=O)C(F)(F)F
• Title of publication: Crystal structures of the trifluoromethyl sulfonates M(SO~3~CF~3~)~2~ (M = Mg, Ca, Ba, Zn, Cu) from synchrotron X-ray powder diffraction data
• Authors of publication: Dinnebier, Robert; Sofina, Natalia; Hildebrandt, Lars; Jansen, Martin
• Journal of publication: Acta Crystallographica, Section B: Structural Science
• Year of publication: 2006
• Journal volume: 62
• Journal issue: 3
• Pages of publication: 467 - 473
• a: 21.7505 ± 0.001 Å
• b: 4.90797 ± 0.00011 Å
• c: 9.6949 ± 0.0003 Å
• α: 90°
• β: 100.379 ± 0.003°
• γ: 90°
• Cell volume: 1018 ± 0.06 ų
• Number of distinct elements: 5
• Space group number: 15
• Hermann-Mauguin space group symbol: I 1 2/a 1
• Hall space group symbol: -I 2ya
• Duplicate of: 2100510
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No