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Information card for entry 1535624
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Coordinates | 1535624.cif |
---|
Chemical name | K15 Na6 (H3 O)9 ((P Y2 W10 O38)4 (W3 O14)) (H2 O)10 |
---|---|
Formula | H47 K15 Na6 O185 P4 W43 Y8 |
Calculated formula | K15 Na6 O185 P4 W43 Y8 |
SMILES | [K+].[K+].[K+].O1[W]23(=O)O[W]4567[O]=P89[O]%10[W]%11%12%13(=O)=[O][Y]%14%15%16%17%18([O]=5)[O]5[W]%19%20%21(=O)[O]%22P%23%24[O]%25%26[W]%27%28(=O)(O%19)O[W]%19%29%25(=O)O[W]%25%26(O%27)(=O)O[W]%26%27%30(=O)[O]%24[W]%24(O%29)(O%26)(=O)O[W]%26([O]=%23)(O%19)(=O)O[W]5(O%28)(=O)[O]%15[W]5%15(O%26)=[O][Y]%19%23%26%28([O]=6)[O]=[W]6%29%31(=O)[O]%32[W]%33(O%29)(=O)(=[O]%19)O[W]%19%29%34(=O)O[W]%35%36(=O)(O6)[O]6%29P%29%32[O]%32[W]%37(=O)(O%19)(O%33)=[O][Y]%19%33%38%39([OH2])(O%23)[O]=[W]%23(=O)[O]%40[W]%41%42%43(=[O]%28)[O]%38[Y]%28%38%44%45([O]=%23)[O]%43[W]%23(=O)=[O][Y]%43([O]%14%21)([O]=[W]%22(O%25)(O%27)(O%20)=O)([O]5%16)([OH2])([O]%41[Y]5%40([O]=%23)([O]%17%43)([O]=4)[O]=[W]4%14(=O)(O3)[O]8[W](=[O]5)(=O)(O4)(O%12)O[W]34(O%13)(=O)[O]95[W](O2)(O%14)(=O)(O3)O[W]25(=O)(O4)O[W]%10(=[O]%18)(=O)(O%11)O[W]1(O7)(=O)O2)O[Y]1([O]=%24)([O]=%30)([O]=%15)([O]=%42)[O]=[W]23(=[O]%26)[O]4[W]5(=O)(O[W](O%31)([O]=%29)(O%36)(=O)O2)O[W]6(O%35)(O%34)(=O)O[W]2%32(O%37)(=O)[O]5[Y]456([O]2%19)([O]3%33)([O]%39%28)[O]=[W]23(=[O]%38)(=[O]1)[O]=P14[O]7[W]89(=[O]5)(=O)O[W]57(=[O]6)(=O)O[W]6(O2)(=O)O[W]2(O3)(=O)O[W]37(=[O]%44)(=O)[O]1[W](=[O]%45)(=O)(O3)(O8)O[W]13(O9)(=O)[O]48[W](O2)(O7)(=O)(O3)O[W]8(O5)(O6)(=O)O1.[K+].O.[K+].[K+].O.[K+].[K+].[Na+].[Na+].[Na+].[OH3+].[OH3+].[OH3+].[OH3+].[OH3+].[OH3+].[OH3+].[OH3+].[OH3+].[K+].[K+].[K+].[K+].O.[K+].[K+].[K+].[Na+].[Na+].[Na+].O.O.O.O.O.O.O |
Title of publication | A new type of heteropolyoxometalates formed from lacunary polyoxotungstate ions and europium or yttrium cations |
Authors of publication | Howell, R.C.; Perez, F.G.; Francesconi, L.C.; Horrocks, W.D.W.jr.; Jain, S.; Rheingold, A.L. |
Journal of publication | Angew. Chem. Int. ed. |
Year of publication | 2001 |
Journal volume | 40 |
Pages of publication | 4031 - 4034 |
a | 22.236 Å |
b | 34.264 Å |
c | 26.698 Å |
α | 90° |
β | 96.271° |
γ | 90° |
Cell volume | 20219.3 Å3 |
Number of distinct elements | 7 |
Space group number | 15 |
Hermann-Mauguin space group symbol | C 1 2/c 1 |
Hall space group symbol | -C 2yc |
Has coordinates | Yes |
Has disorder | No |
Has Fobs | No |
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