Information card for entry 2018066

Structure parameters

• Chemical name: <i>trans</i>-carbonylchloridobis(ferrocenyldiphenylphosphane- κ<i>P</i>)iridium(I) dichloromethane monosolvate
• Formula: C46 H40 Cl3 Fe2 Ir O P2
• Calculated formula: C46 H40 Cl3 Fe2 Ir O P2
• Title of publication: <i>trans</i>-Carbonylchloridobis(ferrocenyldiphenylphosphane-κ<i>P</i>)rhodium(I) dichloromethane monosolvate and <i>trans</i>-carbonylchloridobis(ferrocenyldiphenylphosphane-κ<i>P</i>)iridium(I) dichloromethane monosolvate
• Authors of publication: Muller, Alfred; Otto, Stefanus
• Journal of publication: Acta Crystallographica Section C
• Year of publication: 2011
• Journal volume: 67
• Journal issue: 5
• Pages of publication: m165 - m168
• a: 9.436 ± 0.005 Å
• b: 12.978 ± 0.005 Å
• c: 18.091 ± 0.005 Å
• α: 107.903 ± 0.005°
• β: 96.269 ± 0.005°
• γ: 95.225 ± 0.005°
• Cell volume: 2077.3 ± 1.5 ų
• Cell temperature: 160 ± 2 K
• Ambient diffraction temperature: 160 ± 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: 0.0987
• Residual factor for significantly intense reflections: 0.0475
• Weighted residual factors for significantly intense reflections: 0.0938
• Weighted residual factors for all reflections included in the refinement: 0.1064
• Goodness-of-fit parameter for all reflections included in the refinement: 0.913
• Diffraction radiation wavelength: 0.71069 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: Yes