Information card for entry 2219331

Structure parameters

• Chemical name: <i>N</i>,<i>N</i>'-Bis(3-methoxybenzylidene)ethane-1,2-diamine
• Formula: C18 H20 N2 O2
• Calculated formula: C18 H20 N2 O2
• SMILES: COc1cccc(c1)/C=N/CC/N=C/c1cccc(c1)OC
• Title of publication: <i>N</i>,<i>N</i>'-Bis(3-methoxybenzylidene)ethane-1,2-diamine
• Authors of publication: Fun, Hoong-Kun; Mirkhani, Valiollah; Vartooni, Akbar Rostami
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2008
• Journal volume: 64
• Journal issue: 9
• Pages of publication: o1803 - o1804
• a: 22.7076 ± 0.0003 Å
• b: 6.0374 ± 0.0001 Å
• c: 11.6789 ± 0.0002 Å
• α: 90°
• β: 100.235 ± 0.001°
• γ: 90°
• Cell volume: 1575.64 ± 0.04 ų
• Cell temperature: 100 ± 0.1 K
• Ambient diffraction temperature: 100 ± 0.1 K
• Number of distinct elements: 4
• 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: 0.051
• Residual factor for significantly intense reflections: 0.0409
• Weighted residual factors for significantly intense reflections: 0.102
• Weighted residual factors for all reflections included in the refinement: 0.1082
• Goodness-of-fit parameter for all reflections included in the refinement: 1.105
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes