Information card for entry 4081608

Structure parameters

• Formula: C73.5 H57 Ag2 Au4 Cl4 O4 P3
• Calculated formula: C72 H54 Ag2 Au4 Cl O4 P3
• SMILES: c1(ccccc1)[P]1([Au][C](#Cc2ccccc2)[Ag]2[C]([Au][C]3#[C](c4ccccc4)[Ag]43[C](#Cc3ccccc3)[Au][P](C[P]([Au][C]4#Cc3ccccc3)(c3ccccc3)c3ccccc3)(C1)c1ccccc1)#[C]2c1ccccc1)c1ccccc1.[O-]Cl(=O)(=O)=O
• Title of publication: Structures and Phosphorescence Properties of Triphosphine-Supported Au2Ag2and Au8Ag4Alkynyl Cluster Complexes
• Authors of publication: Xu, Liang-Jin; Wang, Jin-Yun; Zhang, Li-Yi; Shi, Lin-Xi; Chen, Zhong-Ning
• Journal of publication: Organometallics
• Year of publication: 2013
• Journal volume: 32
• Journal issue: 19
• Pages of publication: 5402
• a: 15.89 ± 0.002 Å
• b: 16.609 ± 0.002 Å
• c: 17.78 ± 0.003 Å
• α: 63.603 ± 0.006°
• β: 77.655 ± 0.009°
• γ: 65.354 ± 0.007°
• Cell volume: 3818 ± 1 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 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: 0.0704
• Residual factor for significantly intense reflections: 0.0545
• Weighted residual factors for significantly intense reflections: 0.1337
• Weighted residual factors for all reflections included in the refinement: 0.1417
• Goodness-of-fit parameter for all reflections included in the refinement: 0.96
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No