Information card for entry 8106592

Structure parameters

• Chemical name: (E)-2,6-diisopropyl-N-(pyridin-3-ylmethylene)aniline
• Formula: C18 H22 N2
• Calculated formula: C18 H22 N2
• SMILES: c1(cnccc1)/C=N/c1c(cccc1C(C)C)C(C)C
• Title of publication: The crystal structure of the Schiff base (E)-2,6-diisopropyl-N-(pyridin-3-yl-methylene)aniline, C18H22N2
• Authors of publication: Njogu, Eric M.; Omondi, Bernard; Nyamori, Vincent O.
• Journal of publication: Zeitschrift für Kristallographie - New Crystal Structures
• Year of publication: 2017
• Journal volume: 232
• Journal issue: 4
• Pages of publication: 525 - 526
• a: 8.1226 ± 0.0005 Å
• b: 17.4745 ± 0.001 Å
• c: 11.1822 ± 0.0006 Å
• α: 90°
• β: 102.549 ± 0.002°
• γ: 90°
• Cell volume: 1549.27 ± 0.15 ų
• Cell temperature: 173 ± 2 K
• Ambient diffraction temperature: 173 ± 2 K
• Number of distinct elements: 3
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/c 1
• Hall space group symbol: -P 2ybc
• Residual factor for all reflections: 0.044
• Residual factor for significantly intense reflections: 0.0397
• Weighted residual factors for significantly intense reflections: 0.1031
• Weighted residual factors for all reflections included in the refinement: 0.1071
• Goodness-of-fit parameter for all reflections included in the refinement: 1.039
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No