Information card for entry 4308469

Structure parameters

• Formula: C30 H24 Au I5 P2
• Calculated formula: C30 H24 Au I5 P2
• SMILES: [Au]1(I)(I)[P](c2c([P]1(c1ccccc1)c1ccccc1)cccc2)(c1ccccc1)c1ccccc1.[I-](I)I
• Title of publication: A Cyclic Hexamer of Silver Trifluoroacetate Supported by Four Triphenylphosphine Sulfide Template Molecules
• Authors of publication: Bratislav Djordjevic; Oliver Schuster; Hubert Schmidbaur
• Journal of publication: Inorganic Chemistry
• Year of publication: 2005
• Journal volume: 44
• Pages of publication: 673 - 676
• a: 9.805 ± 0.0001 Å
• b: 14.3361 ± 0.0002 Å
• c: 24.557 ± 0.0003 Å
• α: 90°
• β: 101.442 ± 0.0005°
• γ: 90°
• Cell volume: 3383.27 ± 0.07 ų
• Cell temperature: 143 ± 2 K
• Ambient diffraction temperature: 143 ± 2 K
• Number of distinct elements: 5
• 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: 0.0318
• Residual factor for significantly intense reflections: 0.0312
• Weighted residual factors for significantly intense reflections: 0.0782
• Weighted residual factors for all reflections included in the refinement: 0.0786
• Goodness-of-fit parameter for all reflections included in the refinement: 1.161
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No