Information card for entry 8107245

Structure parameters

• Formula: C23 H34 N2
• Calculated formula: C23 H34 N2
• Title of publication: Crystal structure of N 2,N 4-dimesitylpentane-2,4-diamine, C23H34N2
• Authors of publication: Wallach, Christoph; Klein, Wilhelm; Fässler, Thomas F.
• Journal of publication: Zeitschrift für Kristallographie - New Crystal Structures
• Year of publication: 2022
• Journal volume: 237
• Journal issue: 5
• Pages of publication: 893 - 895
• a: 15.2448 ± 0.0011 Å
• b: 8.2189 ± 0.0005 Å
• c: 16.735 ± 0.0016 Å
• α: 90°
• β: 103.133 ± 0.007°
• γ: 90°
• Cell volume: 2042 ± 0.3 ų
• Cell temperature: 150 ± 2 K
• Ambient diffraction temperature: 150 ± 2 K
• Number of distinct elements: 3
• 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: 0.0651
• Residual factor for significantly intense reflections: 0.0438
• Weighted residual factors for significantly intense reflections: 0.1189
• Weighted residual factors for all reflections included in the refinement: 0.1277
• Goodness-of-fit parameter for all reflections included in the refinement: 1.043
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No