Information card for entry 2239017

Structure parameters

• Chemical name: Hydrido(prolinato-κ^2^<i>N</i>,<i>O</i>)tris(trimethylphosphane-κ<i>P</i>)iridium hexafluoridophosphate
• Formula: C14 H36 F6 Ir N O2 P4
• Calculated formula: C14 H36 F6 Ir N O2 P4
• Title of publication: Hydrido(prolinato-κ^2^<i>N</i>,<i>O</i>)tris(trimethylphosphane-κ<i>P</i>)iridium(III) hexafluoridophosphate
• Authors of publication: Merola, Joseph S.; Roy, Christopher P.
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2014
• Journal volume: 70
• Journal issue: 2
• Pages of publication: m73 - m74
• a: 10.824 ± 0.002 Å
• b: 20.021 ± 0.004 Å
• c: 11.826 ± 0.002 Å
• α: 90°
• β: 91.15 ± 0.01°
• γ: 90°
• Cell volume: 2562.3 ± 0.8 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 7
• Space group number: 4
• Hermann-Mauguin space group symbol: P 1 21 1
• Hall space group symbol: P 2yb
• Residual factor for all reflections: 0.037
• Residual factor for significantly intense reflections: 0.0315
• Weighted residual factors for significantly intense reflections: 0.0724
• Weighted residual factors for all reflections included in the refinement: 0.0751
• Goodness-of-fit parameter for all reflections included in the refinement: 1.055
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: Yes