Information card for entry 2202176

Structure parameters

• Common name: Au2 P6 F12 C51 H46 Cl2
• Chemical name: Bis[bis(diphenylphosphino)methane)digold(I) bishexafluorophosphatedichloromethane disolvate
• Formula: C52 H48 Au2 Cl4 F12 P6
• Calculated formula: C52 H48 Au2 Cl4 F12 P6
• SMILES: [Au]1[P](c2ccccc2)(c2ccccc2)C[P](c2ccccc2)(c2ccccc2)[Au][P](C[P]1(c1ccccc1)c1ccccc1)(c1ccccc1)c1ccccc1.[P](F)(F)(F)(F)(F)[F-].[P](F)(F)(F)(F)(F)[F-].C(Cl)Cl.C(Cl)Cl
• Title of publication: Bis[μ-bis(diphenylphosphino)methane]digold(I) bis(hexafluorophosphate) dichloromethane disolvate
• Authors of publication: Wu, Meimei; Zhang, Liyi; Chen, Zhongning
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2003
• Journal volume: 59
• Journal issue: 2
• Pages of publication: m72 - m73
• a: 20.6825 ± 0.001 Å
• b: 21.0325 ± 0.0009 Å
• c: 13.2577 ± 0.0006 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 5767.2 ± 0.5 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 6
• Space group number: 62
• Hermann-Mauguin space group symbol: P n m a
• Hall space group symbol: -P 2ac 2n
• Residual factor for all reflections: 0.126
• Residual factor for significantly intense reflections: 0.066
• Weighted residual factors for significantly intense reflections: 0.133
• Weighted residual factors for all reflections included in the refinement: 0.16
• Goodness-of-fit parameter for all reflections included in the refinement: 1.13
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes