Information card for entry 4304945

Structure parameters

• Formula: C18 H25 F N2 O Se
• Calculated formula: C18 H25 F N2 O Se
• SMILES: [Se](=O)(c1c(cccc1)CN(C)C)c1c(CN(C)C)cccc1.F
• Title of publication: Studies on the Properties of Organoselenium(IV) Fluorides and Azides
• Authors of publication: Thomas M. Klapötke; Burkhard Krumm; Matthias Scherr
• Journal of publication: Inorganic Chemistry
• Year of publication: 2008
• Journal volume: 47
• Pages of publication: 4712 - 4722
• a: 19.39 ± 0.005 Å
• b: 16.059 ± 0.005 Å
• c: 12.961 ± 0.005 Å
• α: 90°
• β: 118.703 ± 0.005°
• γ: 90°
• Cell volume: 3540 ± 2 ų
• Cell temperature: 100 ± 3 K
• Ambient diffraction temperature: 100 ± 3 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: 0.0732
• Residual factor for significantly intense reflections: 0.0438
• Weighted residual factors for significantly intense reflections: 0.1173
• Weighted residual factors for all reflections included in the refinement: 0.1224
• Goodness-of-fit parameter for all reflections included in the refinement: 0.992
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No