Information card for entry 4087075

Structure parameters

• Formula: C55 H70 Ag F9 N8 O9 S3
• Calculated formula: C55 H70 Ag F9 N8 O9 S3
• Title of publication: A Cationic N-Heterocyclic Carbene Containing an Ammonium Moiety
• Authors of publication: Ruamps, Mirko; Lugan, Noël; César, Vincent
• Journal of publication: Organometallics
• Year of publication: 2017
• Journal volume: 36
• Journal issue: 5
• Pages of publication: 1049
• a: 16.9155 ± 0.0002 Å
• b: 20.1515 ± 0.0002 Å
• c: 37.476 ± 0.0004 Å
• α: 90°
• β: 93.699 ± 0.001°
• γ: 90°
• Cell volume: 12747.9 ± 0.2 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 7
• 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: 0.0498
• Residual factor for significantly intense reflections: 0.049
• Weighted residual factors for significantly intense reflections: 0.1149
• Weighted residual factors for all reflections included in the refinement: 0.1153
• Goodness-of-fit parameter for all reflections included in the refinement: 1.16
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No