Information card for entry 4069947

Structure parameters

• Formula: C52 H42 Au2 P2
• Calculated formula: C52 H42 Au2 P2
• SMILES: [Au]([P](c1ccccc1)(c1ccccc1)c1ccccc1)c1ccc2c(cc([Au][P](c3ccccc3)(c3ccccc3)c3ccccc3)cc2)c1.c1ccccc1
• 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: 9.3178 ± 0.0008 Å
• b: 13.9021 ± 0.0013 Å
• c: 17.961 ± 0.002 Å
• α: 67.653 ± 0.001°
• β: 89.733 ± 0.001°
• γ: 75.532 ± 0.001°
• Cell volume: 2073 ± 0.4 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: 0.0223
• Residual factor for significantly intense reflections: 0.0196
• Weighted residual factors for significantly intense reflections: 0.0641
• Weighted residual factors for all reflections included in the refinement: 0.0734
• Goodness-of-fit parameter for all reflections included in the refinement: 1.154
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No