Information card for entry 7100545

Structure parameters

• Formula: C20 H113.5 Na8.5 O112 Ru2 Sb2 W20
• Calculated formula: C20 Na8.5 O112 Ru2 Sb2 W20
• SMILES: [W]12345[O]=[Ru]6789%10%11([c]%12([cH]6[cH]7[c]8([cH]9[cH]%10%12)C)C(C)C)[O]=[W]678(=O)[O]9%10[W]%12%13(=O)(O[W]%14%15%16(=O)[O]%17%18[W]%19%20%21(=[O][Ru]%22%23%24%25%26%27([O]=[W]%28%29%30(=O)[O]%31%32[W]%33(=O)(O[W]%34%35(=O)([O]%361[W]1(=O)(O3)(O%34)O[W]3%34(=O)([O]%37([W](=O)(O1)(O3)(O[W]%37(=O)(O%22)(O%34)O%30)O[W](O5)(=O)(=O)(O%13)O%20)[Sb]%32%36)O[W]%31(=O)(O%35)(O%33)O%29)O2)(O%28)O[W](=O)(=O)(O4)(O[W]123(=O)[O]4([W](=O)(O[W]%17(=O)(O%19)(O%15)O1)(O[W]9(=O)(O%16)(O%12)O7)(O2)O[W]4(=O)(O%11)(O3)O8)[Sb]%10%18)O%21)[c]1([cH]%27[cH]%26[c]%25([cH]%24[cH]%231)C)C(C)C)O%14)O6.[Na+].[Na+].[Na+].[Na+].[Na+].O.O.O.O.O.O.O.O.O.O.O.O.O.O.O.O.O.O.O.O.O.[Na+].[Na+].[Na+].[Na+].O.O.O.O.O.O.O.O.O.O.O.O.O.O.O.O.O.O.O.O.O
• Title of publication: A Novel Organometallic Heteropolytungstate Deriving from [Sb2W22O74(OH)2]12-:Synthesis and Structural Characterisation of the bis-{Ru(p-cymene)}2±containing Anion [Sb2W20O70{Ru(p-cymene)}2]10-
• Authors of publication: Danielle Laurencin; Richard Villaneau; Patrick Herson; Rene Thouvenot; Yves Jeannin
• Journal of publication: Chemical Communications
• Year of publication: 2005
• a: 15.914 ± 0.006 Å
• b: 15.932 ± 0.005 Å
• c: 24.166 ± 0.009 Å
• α: 100.88 ± 0.03°
• β: 92.11 ± 0.03°
• γ: 97.96 ± 0.03°
• Cell volume: 5946 ± 4 ų
• Cell temperature: 295 ± 2 K
• Ambient diffraction temperature: 295 ± 2 K
• Number of distinct elements: 7
• 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