Information card for entry 4335434

Structure parameters

• Common name: {[Au2(1,4-dppeb)3]I2}n
• Formula: C104 H76 Au2 Cl4 I2 P6
• Calculated formula: C104 H76 Au2 Cl4 I2 P6
• Title of publication: Self-Assembled Supramolecular Clusters Based on Phosphines and Coinage Metals: Tetrahedra, Helicates, and Mesocates
• Authors of publication: Sang Ho Lim; Seth M. Cohen
• Journal of publication: Inorganic Chemistry
• Year of publication: 2013
• Journal volume: 52
• Pages of publication: 7862 - 7872
• a: 10.2728 ± 0.0003 Å
• b: 21.4363 ± 0.0007 Å
• c: 22.0514 ± 0.0007 Å
• α: 78.413 ± 0.002°
• β: 84.505 ± 0.002°
• γ: 76.643 ± 0.002°
• Cell volume: 4622.1 ± 0.3 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 6
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0751
• Residual factor for significantly intense reflections: 0.043
• Weighted residual factors for significantly intense reflections: 0.1065
• Weighted residual factors for all reflections included in the refinement: 0.134
• Goodness-of-fit parameter for all reflections included in the refinement: 1.095
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No