Information card for entry 1572396

Structure parameters

• Formula: C25 H24 Au O P
• Calculated formula: C25 H24 Au O P
• Title of publication: Structure-property relationship of a complex photoluminescent arylacetylide-gold(I) compound. I: a pressure-induced phase transformation caught in the act.
• Authors of publication: Jastrzębska, Róża; Poręba, Tomasz; Cova, Federico; Tchoń, Daniel M; Makal, Anna
• Journal of publication: IUCrJ
• Year of publication: 2024
• Journal volume: 11
• Journal issue: 5
• a: 15.906 ± 0.007 Å
• b: 13.677 ± 0.002 Å
• c: 9.7733 ± 0.0014 Å
• α: 109.591 ± 0.015°
• β: 98.2 ± 0.02°
• γ: 86.14 ± 0.03°
• Cell volume: 1982.2 ± 1 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Ambient diffracton pressure: 800000 kPa
• Sample pressure history: Pressurized to 0.8 GPa and measured without additional time for stabilization.
• 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: 0.3242
• Residual factor for significantly intense reflections: 0.1229
• Weighted residual factors for significantly intense reflections: 0.2712
• Weighted residual factors for all reflections included in the refinement: 0.3677
• Goodness-of-fit parameter for all reflections included in the refinement: 0.914
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 0.41004 Å
• Diffraction radiation type: synchrotron
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No