Information card for entry 2234742

Structure parameters

• Chemical name: Iodido(tri-<i>tert</i>-butylphosphane-κ<i>P</i>)gold(I)
• Formula: C12 H27 Au I P
• Calculated formula: C12 H27 Au I P
• SMILES: [Au](I)[P](C(C)(C)C)(C(C)(C)C)C(C)(C)C
• Title of publication: Iodido(tri-<i>tert</i>-butylphosphane-κ<i>P</i>)gold(I)
• Authors of publication: Sänger, Inge; Lerner, Hans-Wolfram; Sinke, Tanja; Bolte, Michael
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2012
• Journal volume: 68
• Journal issue: 5
• Pages of publication: m708
• a: 7.8198 ± 0.0011 Å
• b: 8.9417 ± 0.0013 Å
• c: 12.3507 ± 0.0019 Å
• α: 85.325 ± 0.012°
• β: 72.84 ± 0.012°
• γ: 80.411 ± 0.012°
• Cell volume: 813.1 ± 0.2 ų
• Cell temperature: 173 ± 2 K
• Ambient diffraction temperature: 173 ± 2 K
• Number of distinct elements: 5
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0391
• Residual factor for significantly intense reflections: 0.0375
• Weighted residual factors for significantly intense reflections: 0.095
• Weighted residual factors for all reflections included in the refinement: 0.0964
• Goodness-of-fit parameter for all reflections included in the refinement: 1.109
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes