Information card for entry 2231654

Structure parameters

• Chemical name: <i>cis</i>-aquaiodidobis(1,10-phenanthroline)cobalt(II) tris(1,10-phenanthroline)cobalt(II) <i>trans</i>-hexa-μ~2~-iodido-hexaiodidotribismuthate(III)
• Formula: C60 H42 Bi3 Co2 I13 N10 O
• Calculated formula: C60 H40 Bi3 Co2 I13 N10 O
• SMILES: [Bi]12(I)(I)(I)[I][Bi]34([I]1)([I]2)[I][Bi]([I]3)([I]4)(I)(I)I.I[Co]12([OH2])([n]3cccc4c3c3[n]1cccc3cc4)[n]1cccc3c1c1[n]2cccc1cc3.[Co]123([n]4cccc5c4c4[n]1cccc4cc5)([n]1cccc4c1c1[n]2cccc1cc4)[n]1cccc2c1c1[n]3cccc1cc2
• Title of publication: A double salt of iodobismuthate: <i>cis</i>-aquaiodidobis(1,10-phenanthroline)cobalt(II) tris(1,10-phenanthroline)cobalt(II) <i>trans</i>-hexa-μ~2~-iodido-hexaiodidotribismuthate(III)
• Authors of publication: Chen, Jiongke; Chai, Wenxiang; Song, Li; Yang, Yunyun; Niu, Feng
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2011
• Journal volume: 67
• Journal issue: 9
• Pages of publication: m1284 - m1285
• a: 35.188 ± 0.008 Å
• b: 17.641 ± 0.004 Å
• c: 12.793 ± 0.003 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 7941 ± 3 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 7
• Space group number: 33
• Hermann-Mauguin space group symbol: P n a 21
• Hall space group symbol: P 2c -2n
• Residual factor for all reflections: 0.0437
• Residual factor for significantly intense reflections: 0.0372
• Weighted residual factors for significantly intense reflections: 0.0786
• Weighted residual factors for all reflections included in the refinement: 0.0824
• Goodness-of-fit parameter for all reflections included in the refinement: 1.038
• Diffraction radiation wavelength: 0.71075 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes