Information card for entry 7108406

Structure parameters

• Formula: C103 H85.5 Ag2 Au6 B4 F16 N6.5 P6 S2
• Calculated formula: C103 H84 Ag2 Au6 B4 F16 N6.5 P6 S2
• Title of publication: A simple nickel bis(dithiolene) complex as an excellent n-type molecular semiconductor for field-effect transistors
• Authors of publication: Li Qu; Jingui Qin
• Journal of publication: Chem.Commun.
• Year of publication: 2012
• Journal volume: 48
• Pages of publication: 9965
• a: 47.6833 ± 0.0012 Å
• b: 72.663 ± 0.003 Å
• c: 13.6472 ± 0.0005 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 47285 ± 3 ų
• Cell temperature: 173 ± 2 K
• Ambient diffraction temperature: 173 ± 2 K
• Number of distinct elements: 9
• Space group number: 43
• Hermann-Mauguin space group symbol: F d d 2
• Hall space group symbol: F 2 -2d
• Residual factor for all reflections: 0.0758
• Residual factor for significantly intense reflections: 0.0499
• Weighted residual factors for significantly intense reflections: 0.1076
• Weighted residual factors for all reflections included in the refinement: 0.1125
• Goodness-of-fit parameter for all reflections included in the refinement: 0.925
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No