Information card for entry 4323727

Structure parameters

• Formula: C10 H19 Au3 Cl3 I6 N3 O3
• Calculated formula: C10 H19 Au3 Cl3 I6 N3 O3
• SMILES: [Au]1(C(=[N]([Au](C(=[N]([Au](C(=[N]1C)OC)(I)I)C)OC)(I)I)C)OC)(I)I.ClC(Cl)Cl
• Title of publication: X-ray Crystallographic Studies of the Products of Oxidative Additions of Iodine to Cyclic Trinuclear Gold(I) Complexes: Directional Effects for Au-I...I-Au Interactions
• Authors of publication: Jess C. Vickery; Alan L. Balch
• Journal of publication: Inorganic Chemistry
• Year of publication: 1997
• Journal volume: 36
• Pages of publication: 5978 - 5983
• a: 8.684 ± 0.005 Å
• b: 11.144 ± 0.006 Å
• c: 15.609 ± 0.007 Å
• α: 87.08°
• β: 82.63°
• γ: 83.39 ± 0.01°
• Cell volume: 1487.1 ± 1.3 ų
• Cell temperature: 123 ± 2 K
• Ambient diffraction temperature: 123 ± 2 K
• Number of distinct elements: 7
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.2232
• Residual factor for significantly intense reflections: 0.1487
• Weighted residual factors for all reflections: 0.4342
• Weighted residual factors for significantly intense reflections: 0.3578
• Goodness-of-fit parameter for all reflections: 2.267
• Goodness-of-fit parameter for significantly intense reflections: 2.534
• Diffraction radiation wavelength: 1.54178 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No