Information card for entry 7003903

Structure parameters

• Formula: C67 H58 B F24 Fe N2 O
• Calculated formula: C67 H58 B F24 Fe N2 O
• Title of publication: Organoiron compounds derived from the indium ‘carbene analogues’, [In{N(Ar)C(Me)}2CH] (Ar = dipp = 2,6-iPr2C6H3; = Mes = 2,4,6-Me3C6H2)
• Authors of publication: Hill, Michael S.; Hitchcock, Peter B.; Pongtavornpinyo, Ruti
• Journal of publication: Dalton Transactions
• Year of publication: 2008
• Journal issue: 21
• Pages of publication: 2854 - 2860
• a: 9.7562 ± 0.0001 Å
• b: 18.5982 ± 0.0002 Å
• c: 35.9837 ± 0.0005 Å
• α: 90°
• β: 90.882 ± 0.001°
• γ: 90°
• Cell volume: 6528.39 ± 0.13 ų
• Cell temperature: 173 ± 2 K
• Ambient diffraction temperature: 173 ± 2 K
• Number of distinct elements: 7
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/c 1
• Hall space group symbol: -P 2ybc
• Residual factor for all reflections: 0.1132
• Residual factor for significantly intense reflections: 0.0748
• Weighted residual factors for significantly intense reflections: 0.1842
• Weighted residual factors for all reflections included in the refinement: 0.2095
• Goodness-of-fit parameter for all reflections included in the refinement: 1.024
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No