Information card for entry 2018817

Structure parameters

• Chemical name: Poly[[tetraaquadi-μ~4~-citrato-tetrakis(2,6-diaminopurine)tetracobalt(II)] 6.35-hydrate]
• Formula: C32 H52.68 Co4 N24 O24.35
• Calculated formula: C32 H46 Co4 N24 O24.33
• Title of publication: A polymeric cobalt(II) complex derived from citric acid (H~4~cit) and 2,6-diaminopurine (dap): {[Co~4~(cit)~2~(dap)~4~(H~2~O)~4~]·6.35H~2~O}~<i>n~</i>
• Authors of publication: Atria, Ana María; Parada, José; Garland, Maria Teresa; Baggio, Ricardo
• Journal of publication: Acta Crystallographica Section C
• Year of publication: 2013
• Journal volume: 69
• Journal issue: 3
• Pages of publication: 212 - 215
• a: 10.548 ± 0.002 Å
• b: 18.669 ± 0.004 Å
• c: 24.795 ± 0.006 Å
• α: 90°
• β: 92.687 ± 0.005°
• γ: 90°
• Cell volume: 4877.3 ± 1.8 ų
• Cell temperature: 150 ± 2 K
• Ambient diffraction temperature: 150 ± 2 K
• Number of distinct elements: 5
• Space group number: 15
• Hermann-Mauguin space group symbol: C 1 2/c 1
• Hall space group symbol: -C 2yc
• Residual factor for all reflections: 0.0657
• Residual factor for significantly intense reflections: 0.0591
• Weighted residual factors for significantly intense reflections: 0.1196
• Weighted residual factors for all reflections included in the refinement: 0.1218
• Goodness-of-fit parameter for all reflections included in the refinement: 1.266
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes