Information card for entry 7714780

Structure parameters

• Formula: C27.5 H25 As Au B Cl2
• Calculated formula: C27.5 H25 As Au B Cl2
• SMILES: [Au]([As]1(c2ccccc2B(c2c1cccc2)c1c(cc(cc1C)C)C)c1ccccc1)Cl.ClCCl
• Title of publication: Synthesis, structures, and photophysical properties of π-extended arsaborins.
• Authors of publication: Sumida, Akifumi; Onishi, Tomoharu; Imoto, Hiroaki; Naka, Kensuke
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2024
• Journal volume: 53
• Journal issue: 4
• Pages of publication: 1706 - 1713
• a: 9.0967 ± 0.0003 Å
• b: 15.1687 ± 0.0007 Å
• c: 20.2163 ± 0.0005 Å
• α: 68.133 ± 0.003°
• β: 88.064 ± 0.002°
• γ: 83.955 ± 0.003°
• Cell volume: 2574.4 ± 0.17 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 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: 0.0419
• Residual factor for significantly intense reflections: 0.029
• Weighted residual factors for significantly intense reflections: 0.0651
• Weighted residual factors for all reflections included in the refinement: 0.0706
• Goodness-of-fit parameter for all reflections included in the refinement: 0.993
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No