Information card for entry 7220093

Structure parameters

• Formula: C69 H76 Au2 Cl2 N4 O6 P2
• Calculated formula: C69 H76 Au2 Cl2 N4 O6 P2
• SMILES: [Au]1([Au]([P](c2cccc3c2Oc2c([P]1(c1ccccc1)c1ccccc1)cccc2C3(C)C)(c1ccccc1)c1ccccc1)C#CC1N(C(=O)NC(=O)C=1)CCCCCCCC)C#CC1N(C(=O)NC(=O)C=1)CCCCCCCC.ClCCl.OC
• Title of publication: Dinuclear organogold(i) complexes bearing uracil moieties: chirality of Au(i)‒Au(i) axis and self-assembly
• Authors of publication: Sakamoto, Yuki; Moriuchi, Toshiyuki; Hirao, Toshikazu
• Journal of publication: CrystEngComm
• Year of publication: 2015
• Journal volume: 17
• Journal issue: 18
• Pages of publication: 3460
• a: 10.6798 ± 0.0006 Å
• b: 14.292 ± 0.0007 Å
• c: 22.3083 ± 0.0013 Å
• α: 97.4663 ± 0.0016°
• β: 90.7906 ± 0.0016°
• γ: 91.1556 ± 0.0014°
• Cell volume: 3375 ± 0.3 ų
• Cell temperature: 277 K
• Ambient diffraction temperature: 277 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: 0.2
• Residual factor for significantly intense reflections: 0.0827
• Weighted residual factors for significantly intense reflections: 0.1781
• Weighted residual factors for all reflections included in the refinement: 0.2321
• Goodness-of-fit parameter for all reflections included in the refinement: 0.964
• Diffraction radiation wavelength: 0.71075 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No