Information card for entry 4069943

Structure parameters

• Formula: C28 H40 Au P
• Calculated formula: C28 H40 Au P
• SMILES: [Au]([P](C1CCCCC1)(C1CCCCC1)C1CCCCC1)c1cc2c(cc1)cccc2
• Title of publication: Mono- and Di-Gold(I) Naphthalenes and Pyrenes: Syntheses, Crystal Structures, and Photophysics
• Authors of publication: Gao, Lei; Peay, Miya A.; Partyka, David V.; Updegraff, James B.; Teets, Thomas S.; Esswein, Arthur J.; Zeller, Matthias; Hunter, Allen D.; Gray, Thomas G.
• Journal of publication: Organometallics
• Year of publication: 2009
• Journal volume: 28
• Journal issue: 19
• Pages of publication: 5669
• a: 9.093 ± 0.003 Å
• b: 10.851 ± 0.004 Å
• c: 12.724 ± 0.004 Å
• α: 83.91 ± 0.004°
• β: 78.774 ± 0.003°
• γ: 83.093 ± 0.004°
• Cell volume: 1218.1 ± 0.7 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: 0.021
• Residual factor for significantly intense reflections: 0.02
• Weighted residual factors for significantly intense reflections: 0.0554
• Weighted residual factors for all reflections included in the refinement: 0.0559
• Goodness-of-fit parameter for all reflections included in the refinement: 1.05
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No