Information card for entry 4316482

Structure parameters

• Formula: C24.5 H25.5 Au Cl3 Ir N2 P
• Calculated formula: C24.5 H25.5 Au Cl3 Ir N2 P
• SMILES: [Au]([P](c1ccccc1)(c1ccccn1)c1cccc[n]1[Ir]123(Cl)[CH]4CC[CH]1=[CH]2CC[CH]3=4)Cl.C(Cl)Cl
• Title of publication: Heteropolynuclear Gold Complexes with Metallophilic Interactions: Modulation of the Luminescent Properties
• Authors of publication: Maria José Calhorda; Carmen Ceamanos; Olga Crespo; M. Concepción Gimeno; Antonio Laguna; Carmen Larraz; Pedro D. Vaz; M. Dolores Villacampa
• Journal of publication: Inorganic Chemistry
• Year of publication: 2010
• Journal volume: 49
• Pages of publication: 8255 - 8269
• a: 18.09 ± 0.004 Å
• b: 17.031 ± 0.003 Å
• c: 17.584 ± 0.004 Å
• α: 90°
• β: 114.23 ± 0.03°
• γ: 90°
• Cell volume: 4940 ± 2 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 7
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/c 1
• Hall space group symbol: -P 2ybc
• Residual factor for all reflections: 0.0662
• Residual factor for significantly intense reflections: 0.0512
• Weighted residual factors for significantly intense reflections: 0.1332
• Weighted residual factors for all reflections included in the refinement: 0.1399
• Goodness-of-fit parameter for all reflections included in the refinement: 1.059
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No