Information card for entry 4323309

Structure parameters

• Formula: C28 H32 Au2 B10 P2 S2
• Calculated formula: C28 H32 Au2 B10 P2 S2
• SMILES: [Au]1[P](c2ccccc2)(c2ccccc2)C=C[P](c2ccccc2)(c2ccccc2)[Au]S[C]2345[BH]678[BH]9%10%11[BH]%12%13%14[BH]%153([BH]3%16%14[BH]%14%11%13[BH]%118%10[BH]847[BH]5%153[BH]%16%14%118)[C]269%12S1
• Title of publication: Synthesis and Characterization of Gold(I) Complexes with the Ligand 1,2-Dithiolate-o-carborane. Crystal Structures of [Au~2~(μ-S~2~C~2~B~10~H~10~)(PPh~3~)~2~], [Au~2~(μ-S~2~C~2~B~10~H~10~)(μ-{(PPh~2~)~2~(CHCH)}], and [Au~2~(μ-S~2~C~2~B~10~H~10~)(μ-{(PPh~2~)~2~)(C~6~H~4~)}]
• Authors of publication: Olga Crespo; M. Concepción Gimeno; Peter G. Jones; Birte Ahrens; Antonio Laguna
• Journal of publication: Inorganic Chemistry
• Year of publication: 1997
• Journal volume: 36
• Pages of publication: 495 - 500
• a: 13.304 ± 0.002 Å
• b: 13.416 ± 0.003 Å
• c: 20.351 ± 0.004 Å
• α: 90°
• β: 109.12 ± 0.02°
• γ: 90°
• Cell volume: 3432 ± 1.2 ų
• Cell temperature: 143 ± 2 K
• Ambient diffraction temperature: 143 ± 2 K
• Number of distinct elements: 6
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/c 1
• Hall space group symbol: -P 2ybc
• Residual factor for all reflections: 0.043
• Residual factor for significantly intense reflections: 0.0329
• Weighted residual factors for all reflections: 0.0842
• Weighted residual factors for significantly intense reflections: 0.0749
• Goodness-of-fit parameter for all reflections: 1.066
• Goodness-of-fit parameter for significantly intense reflections: 1.065
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No