Information card for entry 4323202

Structure parameters

• Formula: C2 H3 Ag B11 Br11
• Calculated formula: Ag B12 Br11.16
• Title of publication: Highly Chlorinated, Brominated, and Iodinated Icosahedral Carborane Anions: 1-H-CB11X11-, 1-CH3-CB11X11- (X = Cl, Br, I); 1-Br-CB11Br11-
• Authors of publication: Zuowei Xie; Chi-Wing Tsang; Eric Tung-Po Sze; Qingchuan Yang; Dominic T. W. Chan; Thomas C. W. Mak
• Journal of publication: Inorganic Chemistry
• Year of publication: 1998
• Journal volume: 37
• Pages of publication: 6444 - 6451
• a: 13.986 ± 0.003 Å
• b: 24.201 ± 0.005 Å
• c: 9.3691 ± 0.0008 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 3171.2 ± 1 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 5
• Space group number: 20
• Hermann-Mauguin space group symbol: C 2 2 21
• Hall space group symbol: C 2c 2
• Residual factor for all reflections: 0.1164
• Residual factor for significantly intense reflections: 0.0956
• Weighted residual factors for all reflections: 0.3137
• Weighted residual factors for significantly intense reflections: 0.2337
• Goodness-of-fit parameter for all reflections: 1.134
• Goodness-of-fit parameter for significantly intense reflections: 1.149
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No