Information card for entry 4314013

Structure parameters

• Formula: C11 H8 Br4 Fe S7 Se2
• Calculated formula: C11 H8 Br4 Fe S7 Se2
• Title of publication: Electrical Conducting and Magnetic Properties of (Ethylenedithiotetrathiafulvalenothioquinone-1,3-diselenolemethide)2 .FeBr4(GaBr4) Crystals with Two Different Interlayer Arrangements of Donor Molecules
• Authors of publication: Takuya Matsumoto; Yohsuke Kamada; Toyonari Sugimoto; Toshiji Tada; Satoru Noguchi; Hiroyuki Nakazumi; Motoo Shiro; Harukazu Yoshino; Keizo Murata
• Journal of publication: Inorganic Chemistry
• Year of publication: 2003
• Journal volume: 42
• Pages of publication: 5192 - 5201
• a: 8.721 ± 0.002 Å
• b: 10.422 ± 0.002 Å
• c: 14.181 ± 0.002 Å
• α: 69.3 ± 0.009°
• β: 75.958 ± 0.003°
• γ: 83.227 ± 0.007°
• Cell volume: 1168.9 ± 0.4 ų
• Cell temperature: 296.2 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 significantly intense reflections: 0.0694
• Weighted residual factors for all reflections included in the refinement: 0.1685
• Goodness-of-fit parameter for all reflections included in the refinement: 1.338
• Diffraction radiation wavelength: 0.7107 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No