Information card for entry 4341862

Structure parameters

• Formula: C94 H96 Au4 F12 O6 P8
• Calculated formula: C94 H96 Au4 F12 O6 P8
• SMILES: C(#Cc1ccc(cc1)OC)[Au][P]1(c2ccccc2)C[P](c2ccccc2)(c2ccccc2)[Au][P](c2ccccc2)(c2ccccc2)C[P](c2ccccc2)([Au]C#Cc2ccc(cc2)OC)C[P](c2ccccc2)(c2ccccc2)[Au][P](C1)(c1ccccc1)c1ccccc1.[P](F)(F)(F)(F)(F)[F-].O=C(C)C.CC(=O)C.[P](F)(F)(F)(F)(F)[F-].O=C(C)C.O=C(C)C
• 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: 17.4943 ± 0.0002 Å
• b: 13.6657 ± 0.0002 Å
• c: 21.3819 ± 0.0003 Å
• α: 90°
• β: 112.526 ± 0.001°
• γ: 90°
• Cell volume: 4721.81 ± 0.12 ų
• Cell temperature: 120 ± 2 K
• Ambient diffraction temperature: 120 ± 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: 0.0247
• Residual factor for significantly intense reflections: 0.0195
• Weighted residual factors for significantly intense reflections: 0.0436
• Weighted residual factors for all reflections included in the refinement: 0.0453
• Goodness-of-fit parameter for all reflections included in the refinement: 1.009
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No