Information card for entry 7029882

Structure parameters

• Chemical name: 2-(2,6-dimethylphenyl)imidazo[1,5-a]pyridin-2-ium hexafluorophosphate
• Formula: C15 H15 F6 N2 P
• Calculated formula: C15 H15 F6 N2 P
• Title of publication: Facile oxidation of NHC-Au(i) to NHC-Au(iii) complexes by CsBr3.
• Authors of publication: Kriechbaum, Margit; Otte, Daniela; List, Manuela; Monkowius, Uwe
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2014
• Journal volume: 43
• Journal issue: 23
• Pages of publication: 8781 - 8791
• a: 9.498 ± 0.005 Å
• b: 17.132 ± 0.008 Å
• c: 10.148 ± 0.005 Å
• α: 90°
• β: 107.178 ± 0.015°
• γ: 90°
• Cell volume: 1577.6 ± 1.4 ų
• Cell temperature: 200 ± 2 K
• Ambient diffraction temperature: 200 ± 2 K
• Number of distinct elements: 5
• Space group number: 15
• Hermann-Mauguin space group symbol: C 1 2/c 1
• Hall space group symbol: -C 2yc
• Residual factor for all reflections: 0.0759
• Residual factor for significantly intense reflections: 0.0518
• Weighted residual factors for significantly intense reflections: 0.1166
• Weighted residual factors for all reflections included in the refinement: 0.1263
• Goodness-of-fit parameter for all reflections included in the refinement: 1.063
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No