Information card for entry 7005455

Structure parameters

• Formula: C70 H48 B Cl2 F24 Ir P2
• Calculated formula: C70 H48 B Cl2 F24 Ir P2
• Title of publication: [Ir(PPh3)2(H)2(ClCH2CH2Cl)][BArF4]: a well characterised transition metal dichloroethane complex.
• Authors of publication: Moxham, Gemma L.; Brayshaw, Simon K.; Weller, Andrew S.
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2007
• Journal issue: 18
• Pages of publication: 1759 - 1761
• a: 14.2336 ± 0.0001 Å
• b: 14.246 ± 0.0001 Å
• c: 17.5082 ± 0.0001 Å
• α: 95.9592 ± 0.0004°
• β: 99.1182 ± 0.0004°
• γ: 100.717 ± 0.0004°
• Cell volume: 3411.51 ± 0.04 ų
• Cell temperature: 150 ± 2 K
• Ambient diffraction temperature: 150 ± 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: 0.0525
• Residual factor for significantly intense reflections: 0.0335
• Weighted residual factors for significantly intense reflections: 0.063
• Weighted residual factors for all reflections included in the refinement: 0.0687
• Goodness-of-fit parameter for all reflections included in the refinement: 1.012
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No