Information card for entry 7031470

Structure parameters

• Formula: C10 H8 Fe I2
• Calculated formula: C10 H8 Fe I2
• Title of publication: Syntheses and purification of the versatile synthons iodoferrocene and 1,1'-diiodoferrocene.
• Authors of publication: Roemer, Max; Nijhuis, Christian A.
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2014
• Journal volume: 43
• Journal issue: 31
• Pages of publication: 11815 - 11818
• a: 14.0018 ± 0.0008 Å
• b: 17.2407 ± 0.001 Å
• c: 14.6467 ± 0.0013 Å
• α: 90°
• β: 110.894 ± 0.0015°
• γ: 90°
• Cell volume: 3303.2 ± 0.4 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 4
• 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: 0.0228
• Residual factor for significantly intense reflections: 0.022
• Weighted residual factors for significantly intense reflections: 0.054
• Weighted residual factors for all reflections included in the refinement: 0.0543
• Goodness-of-fit parameter for all reflections included in the refinement: 1.221
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No