Information card for entry 1568409

Structure parameters

• Formula: C14 H18 Cl4 N2
• Calculated formula: C14 H18 Cl4 N2
• Title of publication: On pyridine chloronium cations
• Authors of publication: Pröhm, Patrick; Berg, Willi; Rupf, Susanne Margot; Müller, Carsten; Riedel, Sebastian
• Journal of publication: Chemical Science
• Year of publication: 2023
• Journal volume: 14
• Journal issue: 9
• Pages of publication: 2325 - 2329
• a: 8.3507 ± 0.001 Å
• b: 6.7026 ± 0.0006 Å
• c: 15.1667 ± 0.0017 Å
• α: 90°
• β: 104.077 ± 0.005°
• γ: 90°
• Cell volume: 823.41 ± 0.15 ų
• Cell temperature: 100 K
• Ambient diffraction temperature: 100 K
• Number of distinct elements: 4
• Space group number: 11
• Hermann-Mauguin space group symbol: P 1 21/m 1
• Hall space group symbol: -P 2yb
• Residual factor for all reflections: 0.0287
• Residual factor for significantly intense reflections: 0.025
• Weighted residual factors for significantly intense reflections: 0.0662
• Weighted residual factors for all reflections included in the refinement: 0.068
• Goodness-of-fit parameter for all reflections included in the refinement: 1.059
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No