Information card for entry 1556670

Structure parameters

• Formula: C36 H26 Au2 Cl F6 O P2 Sb
• Calculated formula: C36 H26 Au2 Cl F6 O P2 Sb
• SMILES: [Au]1[Cl][Au][P](c2c3c(c4c(c([P]1(c1ccccc1)c1ccccc1)ccc4)o3)ccc2)(c1ccccc1)c1ccccc1.[Sb](F)(F)(F)(F)([F-])F
• Title of publication: Dinuclear Gold Complexes Supported by Wide Bite Angle Diphosphines for Preorganization-Induced Selective Dual-Gold Catalysis
• Authors of publication: Lankelma, M.; Vreeken, V.; Siegler, M.A.; van der Vlugt, J.I.
• Journal of publication: Inorganics
• Year of publication: 2019
• Journal volume: 7
• Pages of publication: 28
• a: 10.9408 ± 0.0003 Å
• b: 13.9559 ± 0.0004 Å
• c: 22.9525 ± 0.0008 Å
• α: 88.551 ± 0.003°
• β: 87.044 ± 0.003°
• γ: 89.587 ± 0.002°
• Cell volume: 3498.74 ± 0.19 ų
• Cell temperature: 110 ± 2 K
• Ambient diffraction temperature: 110 ± 2 K
• Number of distinct elements: 8
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0451
• Residual factor for significantly intense reflections: 0.0382
• Weighted residual factors for significantly intense reflections: 0.1077
• Weighted residual factors for all reflections included in the refinement: 0.1116
• Goodness-of-fit parameter for all reflections included in the refinement: 1.038
• Diffraction radiation wavelength: 1.54178 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No