Information card for entry 2101205

Structure parameters

• Formula: C6 H12 Cl2 Na2 O12 U
• Calculated formula: C12 H12 Cl4 Na2 O16 U
• SMILES: [U]12(OC3C(O1)=C(C(C(C=3Cl)=O)=O)Cl)(=O)(=O)([OH2])OC1C(O2)=C(C(C(C=1Cl)=O)=O)Cl.[Na+].O.[Na+].O.O.O.O
• Title of publication: <i>Ab initio</i> structure determination from powder data using direct methods
• Authors of publication: Spengler, R.; Zimmermann, H.; Burzlaff, H.; Jansen, J.; Peschar, R.; Schenk, H.
• Journal of publication: Acta Crystallographica Section B
• Year of publication: 1994
• Journal volume: 50
• Journal issue: 5
• Pages of publication: 578 - 582
• a: 12.217 ± 0.002 Å
• b: 16.543 ± 0.003 Å
• c: 5.9206 ± 0.0001 Å
• α: 90°
• β: 102.57 ± 0.01°
• γ: 90°
• Cell volume: 1167.9 ± 0.3 ų
• Number of distinct elements: 6
• Hermann-Mauguin space group symbol: I 1 m 1
• Hall space group symbol: I -2y
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No