Information card for entry 7018320

Structure parameters

• Formula: C106 H82 Au8 Cl10 O8 P8
• Calculated formula: C106 H82 Au8 Cl10 O8 P8
• SMILES: c1(ccccc1)[P]1(c2ccccc2)[Au]2([Au]345[P](c6ccccc6)(c6ccccc6)C#C[P]([Au]678[Au]9%103([P](C#C1)(c1ccccc1)c1ccccc1)[Au]124[P](C#C[P]([Au]28%10[Au]6([P](c3ccccc3)(c3ccccc3)C#C[P]([Au]57912)(c1ccccc1)c1ccccc1)Cl)(c1ccccc1)c1ccccc1)(c1ccccc1)c1ccccc1)(c1ccccc1)c1ccccc1)Cl.[O-]Cl(=O)(=O)=O.C(Cl)(Cl)Cl.[O-]Cl(=O)(=O)=O.C(Cl)(Cl)Cl
• Title of publication: Synthesis and structures of cyclic gold complexes containing diphosphine ligands and luminescent properties of the high nuclearity species.
• Authors of publication: Bhargava, Suresh; Kitadai, Kunihiko; Masashi, Takahashi; Drumm, Daniel W.; Russo, Salvy P.; Yam, Vivian Wing-Wah; Lee, Terence Kwok-Ming; Wagler, Jörg; Mirzadeh, Nedaossadat
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2012
• Journal volume: 41
• Journal issue: 16
• Pages of publication: 4789 - 4798
• a: 12.62 ± 0.0011 Å
• b: 13.6183 ± 0.0011 Å
• c: 16.819 ± 0.0014 Å
• α: 72.088 ± 0.002°
• β: 73.716 ± 0.002°
• γ: 82.431 ± 0.002°
• Cell volume: 2636.8 ± 0.4 ų
• Cell temperature: 90 ± 2 K
• Ambient diffraction temperature: 90 ± 2 K
• Number of distinct elements: 6
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0783
• Residual factor for significantly intense reflections: 0.0555
• Weighted residual factors for significantly intense reflections: 0.1194
• Weighted residual factors for all reflections included in the refinement: 0.1291
• Goodness-of-fit parameter for all reflections included in the refinement: 1.023
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No