Information card for entry 4336611

Structure parameters

• Formula: C32 H20 Au F2 N O
• Calculated formula: C32 H20 Au F2 N O
• SMILES: C(#Cc1ccc(cc1)OC)[Au]12c3c(c4cc(cc(c5c1cccc5)[n]24)c1c(ccc(c1)F)F)cccc3
• Title of publication: Functionalized Bis-Cyclometalated Alkynylgold(III) Complexes: Synthesis, Characterization, Electrochemistry, Photophysics, Photochemistry, and Electroluminescence Studies
• Authors of publication: Vonika Ka-Man Au; Daniel Ping-Kuen Tsang; Keith Man-Chung Wong; Mei-Yee Chan; Nianyong Zhu; Vivian Wing-Wah Yam
• Journal of publication: Inorganic Chemistry
• Year of publication: 2013
• Journal volume: 52
• Pages of publication: 12713 - 12725
• a: 10.474 ± 0.002 Å
• b: 14.057 ± 0.003 Å
• c: 16.738 ± 0.003 Å
• α: 90°
• β: 97.82 ± 0.02°
• γ: 90°
• Cell volume: 2441.5 ± 0.8 ų
• Cell temperature: 301 ± 2 K
• Ambient diffraction temperature: 301 ± 2 K
• Number of distinct elements: 6
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/n 1
• Hall space group symbol: -P 2yn
• Residual factor for all reflections: 0.0218
• Residual factor for significantly intense reflections: 0.0179
• Weighted residual factors for significantly intense reflections: 0.0463
• Weighted residual factors for all reflections included in the refinement: 0.0484
• Goodness-of-fit parameter for all reflections included in the refinement: 1.032
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No