Information card for entry 4064764

Structure parameters

• Formula: C29 H19 Au F4 N P
• Calculated formula: C29 H19 Au F4 N P
• SMILES: [Au]([P](c1ccccc1)(c1ccccc1)c1ccccc1)c1c(F)c(F)c(c2ccncc2)c(F)c1F
• Title of publication: Design and Synthesis of Polytopic Metalloligands Based on Fluoroaryl Gold(I) Organometallic Compounds
• Authors of publication: Ferrer, Montserrat; Gutiérrez, Albert; Mounir, Mounia; Rodríguez, Laura; Rossell, Oriol; Font-Bardia, Mercè; Gómez-Sal, Pilar; Martín, Avelino; Solans, Xavier
• Journal of publication: Organometallics
• Year of publication: 2011
• Journal volume: 30
• Journal issue: 12
• Pages of publication: 3419
• a: 13.438 ± 0.001 Å
• b: 18.496 ± 0.001 Å
• c: 20.214 ± 0.01 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 5024 ± 3 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 6
• Space group number: 60
• Hermann-Mauguin space group symbol: P b c n
• Hall space group symbol: -P 2n 2ab
• Residual factor for all reflections: 0.0735
• Residual factor for significantly intense reflections: 0.0374
• Weighted residual factors for significantly intense reflections: 0.0839
• Weighted residual factors for all reflections included in the refinement: 0.1061
• Goodness-of-fit parameter for all reflections included in the refinement: 1.232
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No