Information card for entry 7007031

Structure parameters

• Formula: C38 H32 As2 Au2 Br2
• Calculated formula: C38 H32 As2 Au2 Br2
• SMILES: c1([As](c2ccccc2)(c2ccccc2)[Au]Br)c(cc(cc1)C)c1c(ccc(c1)C)[As](c1ccccc1)(c1ccccc1)[Au]Br
• 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: 19.2239 ± 0.0015 Å
• b: 10.7877 ± 0.0009 Å
• c: 18.8728 ± 0.0015 Å
• α: 90°
• β: 112.499 ± 0.002°
• γ: 90°
• Cell volume: 3616 ± 0.5 ų
• Cell temperature: 298 ± 2 K
• Ambient diffraction temperature: 298 ± 2 K
• Number of distinct elements: 5
• Space group number: 15
• Hermann-Mauguin space group symbol: C 1 2/c 1
• Hall space group symbol: -C 2yc
• Residual factor for all reflections: 0.0388
• Residual factor for significantly intense reflections: 0.0281
• Weighted residual factors for significantly intense reflections: 0.063
• Weighted residual factors for all reflections included in the refinement: 0.0666
• Goodness-of-fit parameter for all reflections included in the refinement: 1.026
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No