Information card for entry 4329896

Structure parameters

• Formula: C25 H40 Au P
• Calculated formula: C25 H40 Au P
• SMILES: [Au](c1ccc(cc1)C)[P](C1CCCCC1)(C1CCCCC1)C1CCCCC1
• Title of publication: Arylgold(I) Complexes from Base-Assisted Transmetalation: Structures, NMR Properties, and Density-Functional Theory Calculations
• Authors of publication: David V. Partyka; Matthias Zeller; Allen D. Hunter; Thomas G. Gray
• Journal of publication: Inorganic Chemistry
• Year of publication: 2012
• Journal volume: 51
• Pages of publication: 8394 - 8401
• a: 8.9329 ± 0.0005 Å
• b: 10.5661 ± 0.0006 Å
• c: 12.5173 ± 0.0007 Å
• α: 96.753 ± 0.001°
• β: 101.367 ± 0.001°
• γ: 92.489 ± 0.001°
• Cell volume: 1147.55 ± 0.11 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 4
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0222
• Residual factor for significantly intense reflections: 0.0215
• Weighted residual factors for significantly intense reflections: 0.0534
• Weighted residual factors for all reflections included in the refinement: 0.0537
• Goodness-of-fit parameter for all reflections included in the refinement: 1.056
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No