Information card for entry 7100546

Structure parameters

• Formula: Fe8 K6 Na10 O148 P4 W28
• Calculated formula: Fe8 K6 Na8 O148 P4 W28
• SMILES: [K+].O.[K+].O=[W]1234O[W]567(=O)O[W]89%10(=O)O[W]%11%12(O5)(O[W]5%13%14(O[W]%15(O6)(O2)(O[W]26%16(O[W]%17(=[O][Fe]%18%19%20%21O[Fe]%22%23%24%25O[Fe]%26%27%28([O]=9)O[Fe](O%18)([O]=8)([O]=1)(O[Fe]189%18O[Fe]%29%30%31([O]=[W]%32%33(O[W]%34%35%36(O[W]%37%38%39(=O)O[W]%40%41%42(=O)O[W]%43%44(O%37)(=O)O[W]%37%45%46(O[W]%47(O%38)(O%35)(O[W]%35%38(O%32)(=O)O[W]%32%48(=O)(O%45)O[W](=O)(=[O]8)(O[W]8(O%43)(=[O][Fe]%43(O%20)(O1)([O]=%41)O[Fe](O%29)([O]=%40)([O]=%34)(O%25)[O]%36=P([O]%39%42%44)([O]%46%47)[O]8%43)(O%37)=O)O[W]18(=O)(O%32)O[W](=[O]%30)(=O)(O9)(O[W](=O)(O%35)(O%33)O1)[O]8P(=[O]%18)(O%31)[O]%38%48)=O)=O)=O)=O)O%28)[O]4=P([O]7%10%12)([O]%14%15)[O]%27[W](O%11)(=[O]%26)(O5)(=O)O[W]1(=[O]%22)(O[W]4(O%13)(O2)([O]%16P([O]2[W]5(=[O]%19)(=O)(=[O]%23)O[W](=O)(O6)(O%17)O[W]2(O5)(=O)(O4)O1)(=[O]%24)O%21)=O)=O)(O3)=O)=O)=O)=O)=O.[K+].O.[Na+].[Na+].O.[Na+].O.[Na+].O.O.O.O.O.O.O.O.O.O.[K+].O.[K+].O.[K+].O.[Na+].O.[Na+].[Na+].O.[Na+].O.O.O.O.O.O.O.O.O
• Title of publication: Coordination chemistry of the hexavacant tungstophosphate [H2P2W12O48]12- : synthesis and characterization of iron(III) complexes derived from the unprecedented {P2W14O54} fragment
• Authors of publication: P. Gouzerh; Beatrice Godin; Patrick Herson; Laurent Ruhlmann; Jacqueline Vaissermann; Michel Verdaguer
• Journal of publication: Chemical Communications
• Year of publication: 2005
• a: 12.643 ± 0.015 Å
• b: 15.39 ± 0.008 Å
• c: 19.218 ± 0.01 Å
• α: 83.49 ± 0.05°
• β: 82.73 ± 0.09°
• γ: 79.63 ± 0.06°
• Cell volume: 3633 ± 5 ų
• Cell temperature: 295 K
• Ambient diffraction temperature: 295 K
• Number of distinct elements: 6
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No