Information card for entry 7100534

Structure parameters

• Formula: C8 Co4 K2 N8 Na3 O96 P2 W20
• Calculated formula: C8 Co4 K2 N8 Na3 O96 P2 W20
• SMILES: C1C[NH2][Co]23([NH2]1)([O]=[W]145(O[W]678(=O)O[W]9%10(=O)(O[W]%11(=O)(O[W]%12%13(=O)=[O][Co]%14%15([NH2]CC[NH2]%14)([O]=[W]%14(=O)(O[W]%16(=O)(=O)(O1)[O]4P([O]79)(=[O]%15)[O]1[W]4(=O)(O%16)(O%14)O[W](=O)(O8)(O5)O[W]1(=O)(O%13)(O%11)O4)O%12)[O]=%10)O6)=[O]2)=O)[OH][Co]12([NH2]CC[NH2]1)([O]=[W]145(=O)O[W]678(=O)O[W]9%10(=O)(O[W]%11(=O)(O[W]%12%13(=O)=[O][Co]%14%15([NH2]CC[NH2]%14)([O]=[W]%14(=O)(O[W]%16(=O)(=O)(O1)[O]4P([O]79)(=[O]%15)[O]1[W]4(=O)(O%16)(O%14)O[W](=O)(O8)(O5)O[W]1(=O)(O%13)(O%11)O4)O%12)[O]=%10)O6)=[O]2)[OH]3.[K+].O.O.[Na+].O.O.[Na+].O.O.O.[Na+].O.O.O.O.O.O.O.O.O.O.O.[K+].O.O
• Title of publication: Chelated heteroatoms in polyoxometalates and the topological equivalence of {CoIII(en)} to Type II cis-dioxometal centers. Synthesis and structure of {Co(en)(?-OH)2Co(en)}{PW10O37Co(en)}2]8- and [K?{Co(en)WO4}{WO(H2O)}(PW9O34)2]12-
• Authors of publication: M. Pope; Nebebech Belai
• Journal of publication: Chemical Communications
• Year of publication: 2005
• a: 11.696 ± 0.002 Å
• b: 12.685 ± 0.002 Å
• c: 20.359 ± 0.004 Å
• α: 103.378 ± 0.003°
• β: 90.628 ± 0.003°
• γ: 96.552 ± 0.003°
• Cell volume: 2917.2 ± 0.9 ų
• Cell temperature: 182 ± 2 K
• Ambient diffraction temperature: 182 ± 2 K
• Number of distinct elements: 8
• 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