Information card for entry 4072496

Structure parameters

• Formula: C26 H20 Au F N3 P
• Calculated formula: C26 H20 Au F N3 P
• SMILES: [Au](c1c(c2ccc(cc2)F)nn[nH]1)[P](c1ccccc1)(c1ccccc1)c1ccccc1
• Title of publication: Carbon−Gold Bond Formation through [3 + 2] Cycloaddition Reactions of Gold(I) Azides and Terminal Alkynes
• Authors of publication: Partyka, David V.; Updegraff, James B.; Zeller, Matthias; Hunter, Allen D.; Gray, Thomas G.
• Journal of publication: Organometallics
• Year of publication: 2007
• Journal volume: 26
• Journal issue: 1
• Pages of publication: 183
• a: 12.8693 ± 0.0003 Å
• b: 12.8693 ± 0.0003 Å
• c: 14.655 ± 0.0008 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 2427.14 ± 0.15 ų
• Cell temperature: 260 ± 2 K
• Ambient diffraction temperature: 260 ± 2 K
• Number of distinct elements: 6
• Space group number: 78
• Hermann-Mauguin space group symbol: P 43
• Hall space group symbol: P 4cw
• Residual factor for all reflections: 0.0253
• Residual factor for significantly intense reflections: 0.0225
• Weighted residual factors for significantly intense reflections: 0.0529
• Weighted residual factors for all reflections included in the refinement: 0.0541
• Goodness-of-fit parameter for all reflections included in the refinement: 1.075
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No