Information card for entry 4338292

Structure parameters

• Formula: Co16 Ge4 H244 K1.5 Na30.5 O280 P4 W36
• Calculated formula: Co16 Ge4 Na18 O203 P4 W36
• SMILES: [Ge]123[O]45[W]678(O[W]9%10%11(O[W]%12%13(=[O][Co]%14%15%16%17[O]=P%18%19[O]%20%21[Co]%22%23%24%25[O]%16[Co]%16%26%27([O]=P%28%29[O]%30%23[Co]%23%31%32%21[O]%21[Co]%33%34%35(O%28)[O]=[W]%28%36%37(O[W]%38%39%40(O[W]%41%42([O]%43%44[Ge]%45%46[O]%34%28[W]%28(=[O]%33)(=O)(O%36)O[W]%33%34%36(=[O][Co]%47%48([O]=P%49%50[O]%51%23[Co]%23%52%53%20[O]%20%22P(=[O][Co]%22%54%55%56[O]=[W]%57%58%59(O[W]%60%61%62(O[W]%63%64([O]%65%66[Ge]%67%68[O]%54%57[W]%54(=[O]%22)(=O)(O%58)O[W]%22%57%58(=[O][Co]%69%70(O%18)([O]=[W]%18([O]%67%22%69)(=O)(O%57)O[W]%22(=[O][Co]([O]%23%55)(O%50)([O]=%60)([O]%61%68%22)[O]%53%70)(=O)(O%62)O[W]%66(O[W]%65(O%63)(O%54)(=O)O%58)(O%18)(=O)O%64)[O]%52%56)=O)(=O)O%59)=O)=O)(O[Co]%18%22([O]=[W]%23%50%52(O[W](=[O]%14)([O]1%12%15)(=O)(O%13)O[W]4(O6)(=O)(O[W]15(O[W](=[O]%18)([O]2%22%23)(=O)(O%50)O[W](=[O]%16)(=O)([O]3%10%26)(O%11)O1)(=O)O8)O%52)=O)([O]%17%24)[O]%25%27)O[Co]1234[O]5[Co]68%10(O%49)[O]=[W]%11%12%13(O[W]%14%15(O[W]%16%17([O]%18%22[Ge]%23%24[O]8%11[W]8(=[O]6)(=O)(O%12)O[W]6%11%12(=[O][Co]%25%26(O%29)([O]=[W]%27([O]%236%25)(=O)(O%11)O[W](=[O]1)(=O)([O]3%14%24)(O%15)O[W]%22(O[W]%18(O%16)(O8)(=O)O%12)(O%27)(=O)O%17)[O]%10[Co]%30%51%205[O]4%26)=O)(=O)O%13)(=[O]2)=O)=O)([O]=[W]1([O]%45%33%47)(=O)(O%34)O[W]2(=[O][Co]%21(O%19)(O%38)([O]%39%462)[O]%32%48)(=O)(O%40)O[W]%44(O[W]%43(O%41)(O%28)(=O)O%36)(O1)(=O)O%42)[O]%31%35)=O)(=O)O%37)=O)=O)[O]=9)(=O)O7)=O)=O.O.O.O.O.O.O.O.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+].[Na+].[Na+].[Na+].[Na+].[Na+].[Na+].[Na+].[Na+].[Na+].[Na+].[Na+].[Na+].[Na+].[Na+].O.O.O.O.O.O.O.O.O.O.O
• Title of publication: Multinuclear Cobalt(II)-Containing Heteropolytungstates: Structure, Magnetism, and Electrochemistry.
• Authors of publication: Ibrahim, Masooma; Haider, Ali; Lan, Yanhua; Bassil, Bassem S.; Carey, Akina M.; Liu, Rongji; Zhang, Guangjin; Keita, Bineta; Li, Wenhui; Kostakis, George E.; Powell, Annie K.; Kortz, Ulrich
• Journal of publication: Inorganic chemistry
• Year of publication: 2014
• Journal volume: 53
• Journal issue: 10
• Pages of publication: 5179 - 5188
• a: 35.565 ± 0.0009 Å
• b: 35.565 ± 0.0009 Å
• c: 35.565 ± 0.0009 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 44985 ± 2 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 8
• Space group number: 203
• Hermann-Mauguin space group symbol: F d -3 :2
• Hall space group symbol: -F 2uv 2vw 3
• Residual factor for all reflections: 0.1165
• Residual factor for significantly intense reflections: 0.0733
• Weighted residual factors for significantly intense reflections: 0.1881
• Weighted residual factors for all reflections included in the refinement: 0.2433
• Goodness-of-fit parameter for all reflections included in the refinement: 1.004
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No