Information card for entry 4076515

Structure parameters

• Formula: C64 H56 Au4 Cl4 N2 O0 P4
• Calculated formula: C64 H56 Au4 Cl4 N2 P4
• SMILES: c1(ccc(cc1)c1ccc(cc1)N(C[P](c1ccccc1)([Au]Cl)c1ccccc1)C[P]([Au]Cl)(c1ccccc1)c1ccccc1)N(C[P](c1ccccc1)([Au]Cl)c1ccccc1)C[P]([Au]Cl)(c1ccccc1)c1ccccc1
• Title of publication: Gold(I) Chloride Complexes of Polyphosphine Ligands with Electron-Rich Arene Spacer: Gold‒Arene Interactions
• Authors of publication: Ni, Qing-Ling; Jiang, Xuan-Feng; Huang, Ting-Hong; Wang, Xiu-Jian; Gui, Liu-Cheng; Yang, Kun-Guo
• Journal of publication: Organometallics
• Year of publication: 2012
• Journal volume: 31
• Journal issue: 6
• Pages of publication: 2343
• a: 17.476 ± 0.003 Å
• b: 11.628 ± 0.002 Å
• c: 17.143 ± 0.003 Å
• α: 90°
• β: 117.887 ± 0.003°
• γ: 90°
• Cell volume: 3079.1 ± 0.9 ų
• Cell temperature: 110 ± 2 K
• Ambient diffraction temperature: 110 ± 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: 0.0712
• Residual factor for significantly intense reflections: 0.0433
• Weighted residual factors for significantly intense reflections: 0.1051
• Weighted residual factors for all reflections included in the refinement: 0.1244
• Goodness-of-fit parameter for all reflections included in the refinement: 1.021
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No