Information card for entry 2004846

Structure parameters

• Chemical name: bis(pentamethylcyclopentadienyl)tetra(μ-iodo)dimolybdenum(III,IV) tetraiodoferrate(III), inclusion complex with bis(pentamethylcyclopentadienyl)di(μ-iodo)(μ-oxo)diiododimolybdenum(IV)
• Formula: C40 H60 Fe I12 Mo4 O
• Calculated formula: C40 H60 Fe I12 Mo4 O
• Title of publication: [(η^5^-C~5~Me~5~)~2~Mo~2~(μ-I)~4~]^+^[FeI~4~]^{-^}.[(η^5^-C~5~Me~5~)~2~Mo~2~I~2~(μ-I)~2~(μ-O)]
• Authors of publication: Gordon, J. C.; Fanwick, P. E.; Poli, R.
• Journal of publication: Acta Crystallographica Section C
• Year of publication: 1996
• Journal volume: 52
• Journal issue: 5
• Pages of publication: 1098 - 1101
• a: 12.0939 ± 0.0007 Å
• b: 15.464 ± 0.004 Å
• c: 16.854 ± 0.002 Å
• α: 90°
• β: 105.295 ± 0.006°
• γ: 90°
• Cell volume: 3040.4 ± 0.9 ų
• Cell temperature: 20 K
• Ambient diffraction temperature: 20 K
• Number of distinct elements: 6
• Space group number: 11
• Hermann-Mauguin space group symbol: P 1 21/m 1
• Hall space group symbol: -P 2yb
• Residual factor for all reflections: 0.048
• Residual factor for significantly intense reflections: 0.048
• Weighted residual factors for significantly intense reflections: 0.063
• Goodness-of-fit parameter for significantly intense reflections: 1.619
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No