Information card for entry 4115357

Structure parameters

• Common name: gold-complex
• Formula: C26 H37 Au F P
• Calculated formula: C26 H37 Au F P
• SMILES: [Au](C#Cc1ccc(F)cc1)[P](C1CCCCC1)(C1CCCCC1)C1CCCCC1
• Title of publication: Organic Triplet Emissions of Arylacetylide Moieties Harnessed through Coordination to [Au(PCy3)]+. Effect of Molecular Structure upon Photoluminescent Properties
• Authors of publication: Hsiu-Yi Chao; Wei Lu; Yanqin Li; Michael C. W. Chan; Chi-Ming Che; Kung-Kai Cheung; Nianyong Zhu
• Journal of publication: Journal of the American Chemical Society
• Year of publication: 2002
• Journal volume: 124
• Pages of publication: 14696 - 14706
• a: 9.579 ± 0.001 Å
• b: 11.34 ± 0.001 Å
• c: 22.543 ± 0.002 Å
• α: 90°
• β: 91.59°
• γ: 90°
• Cell volume: 2447.8 ± 0.4 ų
• Cell temperature: 301 ± 2 K
• Ambient diffraction temperature: 301 ± 2 K
• Number of distinct elements: 5
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/c 1
• Hall space group symbol: -P 2ybc
• Residual factor for all reflections: 0.0437
• Residual factor for significantly intense reflections: 0.0356
• Weighted residual factors for significantly intense reflections: 0.0957
• Weighted residual factors for all reflections included in the refinement: 0.109
• Goodness-of-fit parameter for all reflections included in the refinement: 1.15
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No