Information card for entry 2222365

Structure parameters

• Chemical name: Bis[bis(1,10-phenanthroline-κ^2^<i>N</i>,<i>N</i>')copper(I)] μ~6~-oxido-dodecakis-μ~2~-oxido-hexaoxidohexatungsten(VI)
• Formula: C48 H32 Cu2 N8 O19 W6
• Calculated formula: C48 H32 Cu2 N8 O19 W6
• SMILES: c1ccc2ccc3ccc[n]4[Cu]5([n]1c2c34)[n]1cccc2c1c1[n]5cccc1cc2.O1[W]234(=O)O[W]567(O[W]89%10(O[W]%11%121(=O)O[W](O5)(=O)(O8)(O3)[O]47%10%12[W](O%11)(O6)(=O)(O2)O9)=O)=O.c1ccc2ccc3ccc[n]4c3c2[n]1[Cu]14[n]2cccc3ccc4ccc[n]1c4c23
• Title of publication: Bis[bis(1,10-phenanthroline-κ^2^<i>N</i>,<i>N</i>')copper(I)] μ~6~-oxido-dodecakis-μ~2~-oxido-hexaoxidohexatungsten(VI)
• Authors of publication: Li, Zhen-Fang; Zhang, Bi-Song; Wu, Chang-Sheng
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2009
• Journal volume: 65
• Journal issue: 7
• Pages of publication: m741 - m742
• a: 10.364 ± 0.002 Å
• b: 11.772 ± 0.002 Å
• c: 11.899 ± 0.002 Å
• α: 108.603 ± 0.003°
• β: 102.151 ± 0.003°
• γ: 100.694 ± 0.003°
• Cell volume: 1294.1 ± 0.4 ų
• Cell temperature: 290 ± 2 K
• Ambient diffraction temperature: 290 ± 2 K
• Number of distinct elements: 6
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0743
• Residual factor for significantly intense reflections: 0.0592
• Weighted residual factors for significantly intense reflections: 0.1497
• Weighted residual factors for all reflections included in the refinement: 0.1568
• Goodness-of-fit parameter for all reflections included in the refinement: 0.995
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes