Information card for entry 4341859

Structure parameters

• Formula: C91 H94 Au4 F12 O3 P8
• Calculated formula: C91 H94 Au4 F12 O3 P8
• SMILES: C(#Cc1ccccc1)[Au][P]1(c2ccccc2)C[P](c2ccccc2)(c2ccccc2)[Au][P](c2ccccc2)(c2ccccc2)C[P](c2ccccc2)([Au]C#Cc2ccccc2)C[P](c2ccccc2)(c2ccccc2)[Au][P](C1)(c1ccccc1)c1ccccc1.[P](F)(F)(F)(F)(F)[F-].O(CC)CC.CC(=O)C.[P](F)(F)(F)(F)(F)[F-].O(CC)CC
• Title of publication: Tetragold(I) Complexes: Solution Isomerization and Tunable Solid-State Luminescence.
• Authors of publication: Dau, Thuy Minh; Chen, Yi-An; Karttunen, Antti J.; Grachova, Elena V.; Tunik, Sergey P.; Lin, Ke-Ting; Hung, Wen-Yi; Chou, Pi-Tai; Pakkanen, Tapani A.; Koshevoy, Igor O.
• Journal of publication: Inorganic chemistry
• Year of publication: 2014
• Pages of publication: 141201154356007
• a: 32.1993 ± 0.0005 Å
• b: 13.8892 ± 0.0002 Å
• c: 22.3049 ± 0.0003 Å
• α: 90°
• β: 116.198 ± 0.001°
• γ: 90°
• Cell volume: 8950.5 ± 0.2 ų
• Cell temperature: 120 ± 2 K
• Ambient diffraction temperature: 120 ± 2 K
• Number of distinct elements: 6
• Space group number: 15
• Hermann-Mauguin space group symbol: C 1 2/c 1
• Hall space group symbol: -C 2yc
• Residual factor for all reflections: 0.0269
• Residual factor for significantly intense reflections: 0.021
• Weighted residual factors for significantly intense reflections: 0.0472
• Weighted residual factors for all reflections included in the refinement: 0.0496
• Goodness-of-fit parameter for all reflections included in the refinement: 1.026
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No