Information card for entry 2102817

Structure parameters

• Formula: C2 H2 Cs2 O5
• Calculated formula: C2 H2 Cs2 O5
• SMILES: C(=O)([O-])C(=O)[O-].O.[Cs+].[Cs+]
• Title of publication: Rapid structure determination of the hydrogen-containing compound Cs~2~C~2~O~4~·H~2~O by joint single-crystal X-ray and powder neutron diffraction
• Authors of publication: Weller, Mark T.; Henry, Paul F.; Light, Mark E.
• Journal of publication: Acta Crystallographica Section B
• Year of publication: 2007
• Journal volume: 63
• Journal issue: 3
• Pages of publication: 426 - 432
• a: 10.075 ± 0.005 Å
• b: 6.6473 ± 0.0003 Å
• c: 11.2997 ± 0.0006 Å
• α: 90°
• β: 107.189 ± 0.003°
• γ: 90°
• Cell volume: 722.9 ± 0.4 ų
• Number of distinct elements: 4
• Space group number: 15
• Hermann-Mauguin space group symbol: C 1 2/c 1
• Hall space group symbol: -C 2yc
• Goodness-of-fit parameter for all reflections: 1.82
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No