Information card for entry 2217757

Structure parameters

• Chemical name: <i>N</i>-{(<i>E</i>)-4-[(<i>E</i>)-(Dodecylimino)methyl]benzylidene}dodecan-\ 1-imine ?
• Formula: C32 H56 N2
• Calculated formula: C32 H56 N2
• SMILES: CCCCCCCCCCCC/N=C/c1ccc(cc1)/C=N/CCCCCCCCCCCC
• Title of publication: <i>N</i>-{(<i>E</i>)-4-[(<i>E</i>)-(Dodecylimino)methyl]benzylidene}dodecan-1-imine
• Authors of publication: Wang, Bin; Wan, Rong; Yin, Li-He; Han, Feng; Wang, Jin-Tang
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2008
• Journal volume: 64
• Journal issue: 3
• Pages of publication: o565
• a: 4.737 ± 0.0009 Å
• b: 5.519 ± 0.0011 Å
• c: 30.315 ± 0.006 Å
• α: 91.18 ± 0.03°
• β: 93.44 ± 0.03°
• γ: 101.75 ± 0.03°
• Cell volume: 774.1 ± 0.3 ų
• Cell temperature: 298 ± 2 K
• Ambient diffraction temperature: 298 ± 2 K
• Number of distinct elements: 3
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.1484
• Residual factor for significantly intense reflections: 0.0645
• Weighted residual factors for significantly intense reflections: 0.1428
• Weighted residual factors for all reflections included in the refinement: 0.1714
• Goodness-of-fit parameter for all reflections included in the refinement: 1.061
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes