Information card for entry 7105805

Structure parameters

• Chemical name: 5-dimethylamino-3-chloro-penta-2,4-dienylidenyl-dimethylammonium tetrafluoroborate
• Formula: C9 H16 B Cl F4 N2
• Calculated formula: C9 H16 B Cl F4.02 N2
• Title of publication: Metal complexes with carbene ligands stabilized by lateral enamines
• Authors of publication: Manuel Alcarazo; Karin Radkowski; Richard Goddard; Alois Furstner
• Journal of publication: Chem.Commun.
• Year of publication: 2011
• Journal volume: 47
• Pages of publication: 776
• a: 10.2205 ± 0.0008 Å
• b: 12.2695 ± 0.0009 Å
• c: 9.9747 ± 0.0007 Å
• α: 90°
• β: 97.135 ± 0.004°
• γ: 90°
• Cell volume: 1241.15 ± 0.16 ų
• Cell temperature: 100 K
• Ambient diffraction temperature: 100 K
• Number of distinct elements: 6
• 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: 0.0464
• Residual factor for significantly intense reflections: 0.045
• Weighted residual factors for significantly intense reflections: 0.1127
• Weighted residual factors for all reflections included in the refinement: 0.1137
• Goodness-of-fit parameter for all reflections included in the refinement: 1.085
• Diffraction radiation wavelength: 1.54178 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No