Information card for entry 2019636

Structure parameters

• Common name: 2225
• Chemical name: ([2.2.2]Cryptand)potassium(I) bis(2,2'-bipyridine)cobaltate(‒I) anthrancene hemisolvate tetrahydrofuran disolvate
• Formula: C53 H73 Co K N6 O8
• Calculated formula: C53 H73 Co K N6 O8
• Title of publication: Homoleptic 2,2'-bipyridine metalates(‒I) of iron and cobalt, one cocrystallized with an anthracene radical anion and the other with neutral anthracene
• Authors of publication: Brennessel, William W.; Ellis, John E.
• Journal of publication: Acta Crystallographica Section C
• Year of publication: 2014
• Journal volume: 70
• Journal issue: 8
• Pages of publication: 828 - 832
• a: 10.5981 ± 0.0008 Å
• b: 14.4323 ± 0.0011 Å
• c: 18.4886 ± 0.0015 Å
• α: 99.1054 ± 0.0013°
• β: 90.8279 ± 0.0014°
• γ: 109.243 ± 0.0013°
• Cell volume: 2629.5 ± 0.4 ų
• Cell temperature: 173 ± 2 K
• Ambient diffraction temperature: 173 ± 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: 0.0433
• Residual factor for significantly intense reflections: 0.031
• Weighted residual factors for significantly intense reflections: 0.0739
• Weighted residual factors for all reflections included in the refinement: 0.0786
• Goodness-of-fit parameter for all reflections included in the refinement: 1.031
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: Yes