Information card for entry 2216668

Structure parameters

• Chemical name: 5-Diethylamino-2-[(Z)-(4-methyl-3-nitrophenyl)iminomethyl]phenol
• Formula: C18 H21 N3 O3
• Calculated formula: C18 H21 N3 O3
• Title of publication: 5-Diethylamino-2-[(<i>Z</i>)-(4-methyl-3-nitrophenyl)iminomethyl]phenol
• Authors of publication: Sarojini, B. K.; Narayana, B.; Mustafa, K.; Yathirajan, H. S.; Bolte, Michael
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2007
• Journal volume: 63
• Journal issue: 12
• Pages of publication: o4782 - o4782
• a: 7.3157 ± 0.0004 Å
• b: 22.3708 ± 0.001 Å
• c: 10.3849 ± 0.0006 Å
• α: 90°
• β: 103.571 ± 0.005°
• γ: 90°
• Cell volume: 1652.12 ± 0.15 ų
• Cell temperature: 173 ± 2 K
• Ambient diffraction temperature: 173 ± 2 K
• Number of distinct elements: 4
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/n 1
• Hall space group symbol: -P 2yn
• Residual factor for all reflections: 0.0729
• Residual factor for significantly intense reflections: 0.0663
• Weighted residual factors for significantly intense reflections: 0.1861
• Weighted residual factors for all reflections included in the refinement: 0.1919
• Goodness-of-fit parameter for all reflections included in the refinement: 0.973
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: Yes