Information card for entry 7007038

Structure parameters

• Formula: C38 H32 As2 Au2 Cl2
• Calculated formula: C38 H32 As2 Au2 Cl2
• SMILES: [Au]([As](c1c(c(ccc1)C)Cl)(c1ccccc1)c1ccccc1)c1c([As]([Au]Cl)(c2ccccc2)c2ccccc2)cccc1C
• Title of publication: Synthesis, structures and reactions of cyclometallated gold complexes containing (2-diphenylarsino-n-methyl)phenyl (n = 5, 6).
• Authors of publication: Kitadai, Kunihiko; Takahashi, Masashi; Takeda, Masuo; Bhargava, Suresh K.; Privér, Steven H; Bennett, Martin A.
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2006
• Journal issue: 21
• Pages of publication: 2560 - 2571
• a: 9.0921 ± 0.0012 Å
• b: 15.991 ± 0.002 Å
• c: 24.704 ± 0.003 Å
• α: 90°
• β: 97.868 ± 0.003°
• γ: 90°
• Cell volume: 3557.9 ± 0.8 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 5
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/n 1
• Hall space group symbol: -P 2yn
• Residual factor for all reflections: 0.0957
• Residual factor for significantly intense reflections: 0.0595
• Weighted residual factors for significantly intense reflections: 0.1483
• Weighted residual factors for all reflections included in the refinement: 0.1642
• Goodness-of-fit parameter for all reflections included in the refinement: 1.025
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No