Information card for entry 4343915

Structure parameters

• Chemical name: K2 (Cu (H2 O)6) (S O4)1.557 (Se O4)0.444
• Formula: Cu H12 K2 O14.004 S1.557 Se0.444
• Calculated formula: Cu H12 K2 O14 S1.5568 Se0.444
• Title of publication: Influence of lattice interactions on the Jahn-Teller distortion of the [Cu (H2 O)6](2+) ion: dependence of the crystal structure of K2 [Cu (H2 O)6] (S O4)(2x) (Se O4)(2-2x) upon the sulfate/selenate ratio
• Authors of publication: Simmons, C.J.; Stratemeier, H.; Hitchman, M.A.; Riley, M.J.
• Journal of publication: Inorganic Chemistry
• Year of publication: 2006
• Journal volume: 45
• Pages of publication: 1021 - 1031
• a: 9.1135 Å
• b: 12.1688 Å
• c: 6.2069 Å
• α: 90°
• β: 104.279°
• γ: 90°
• Cell volume: 667.082 ų
• Number of distinct elements: 6
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/a 1
• Hall space group symbol: -P 2yab
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No