Information card for entry 2012533

Structure parameters

• Chemical name: bis[1,1',2,2',3,3',4,4'-octamethyl-5-(2-pyridinio)-5'-(2-pyridyl)ferrocene] di-μ~3~-chloro-hexadeca-μ~2~-chloro-hexachlorodi-μ~4~-oxo-di-μ~3~-oxo- bis[(η^5^,κN)-1,2,3,4-tetramethyl-5-(2-pyridyl)cyclopentadienyl] octauranium(IV) dichloromethane tetrasolvate
• Formula: C88 H106 Cl32 Fe2 N6 O4 U8
• Calculated formula: C88 H106 Cl32 Fe2 N6 O4 U8
• Title of publication: An ion pair formed by protonated Fe(cp*py)~2~ and the octanuclear cluster U~8~Cl~24~O~4~(cp*py)~2~ [cp*py is tetramethyl-5-(2-pyridyl)cyclopentadiene]
• Authors of publication: Moisan, Lionel; Le Borgne, Thierry; Thuéry, Pierre; Ephritikhine, Michel
• Journal of publication: Acta Crystallographica Section C
• Year of publication: 2002
• Journal volume: 58
• Journal issue: 2
• Pages of publication: m98 - m101
• a: 14.3894 ± 0.0008 Å
• b: 15.9758 ± 0.0007 Å
• c: 16.0646 ± 0.0009 Å
• α: 61.128 ± 0.003°
• β: 70.648 ± 0.002°
• γ: 83.316 ± 0.003°
• Cell volume: 3047 ± 0.3 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 7
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.069
• Residual factor for significantly intense reflections: 0.044
• Weighted residual factors for significantly intense reflections: 0.088
• Weighted residual factors for all reflections included in the refinement: 0.097
• Goodness-of-fit parameter for all reflections included in the refinement: 1.026
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes