Information card for entry 7203976

Structure parameters

• Formula: C12 H6 F2 S4 Se4 Ta0.33
• Calculated formula: C12 H6 F1.98 S4 Se4 Ta0.33
• Title of publication: Preparation, structures and physical properties of selenium analogues of DTEDT as promising donors for organic metals
• Authors of publication: Fujiwara, Hideki; Misaki, Yohji; Yamabe, Tokio; Mori, Takehiko; Mori, Hatsumi; Tanaka, Shoji
• Journal of publication: Journal of Materials Chemistry
• Year of publication: 2000
• Journal volume: 10
• Journal issue: 7
• Pages of publication: 1565
• a: 6.438 ± 0.001 Å
• b: 19.151 ± 0.002 Å
• c: 3.93 ± 0.001 Å
• α: 92.69 ± 0.02°
• β: 95.76 ± 0.02°
• γ: 93.7 ± 0.01°
• Cell volume: 480.4 ± 0.15 ų
• Cell temperature: 293.2 K
• Ambient diffraction temperature: 293.2 K
• Number of distinct elements: 6
• Space group number: 1
• Hermann-Mauguin space group symbol: P 1
• Hall space group symbol: P 1
• Residual factor for significantly intense reflections: 0.0434
• Weighted residual factors for significantly intense reflections: 0.0474
• Goodness-of-fit parameter for significantly intense reflections: 2.364
• Diffraction radiation wavelength: 0.7107 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No