Information card for entry 8104628

Structure parameters

• Formula: C20 H22 F6 I2 N3 Sb
• Calculated formula: C20 H22 F6 I2 N3 Sb
• Title of publication: The crystal structure of 4,5-diiodo-1,3-dimesityl-1H-1,2,3-triazol-3-ium hexafluoridoantimonate(V), C20H22F6I2N3Sb
• Authors of publication: Xu, Xingyu; Qiu, Ping
• Journal of publication: Zeitschrift für Kristallographie - New Crystal Structures
• Year of publication: 2021
• Journal volume: 236
• Journal issue: 5
• Pages of publication: 935 - 936
• a: 10.2268 ± 0.001 Å
• b: 10.885 ± 0.0009 Å
• c: 12.1413 ± 0.001 Å
• α: 101.81 ± 0.002°
• β: 90.465 ± 0.003°
• γ: 103.194 ± 0.003°
• Cell volume: 1285.9 ± 0.2 ų
• Cell temperature: 199.95 K
• Ambient diffraction temperature: 199.95 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 all reflections: 0.034
• Residual factor for significantly intense reflections: 0.0291
• Weighted residual factors for significantly intense reflections: 0.0695
• Weighted residual factors for all reflections included in the refinement: 0.0717
• Goodness-of-fit parameter for all reflections included in the refinement: 1.094
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No