Information card for entry 2219469

Structure parameters

• Chemical name: N,N'-Bis[(<i>E</i>)-2-Benzylidenepropylidene]ethane-1,2-diamine
• Formula: C22 H24 N2
• Calculated formula: C22 H24 N2
• SMILES: CC(=C\c1ccccc1)/C=N/CC/N=C/C(=C/c1ccccc1)C
• Title of publication: <i>N</i>,<i>N</i>'-Bis[(<i>E</i>)-2-Benzylidenepropylidene]ethane-1,2-diamine
• Authors of publication: Khalaji, Aliakbar Dehno; Ng, Seik Weng
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2008
• Journal volume: 64
• Journal issue: 9
• Pages of publication: o1771
• a: 9.524 ± 0.002 Å
• b: 9.576 ± 0.002 Å
• c: 10.202 ± 0.002 Å
• α: 88.16 ± 0.003°
• β: 76.865 ± 0.002°
• γ: 78.651 ± 0.003°
• Cell volume: 888.3 ± 0.3 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 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: 0.0915
• Residual factor for significantly intense reflections: 0.0689
• Weighted residual factors for significantly intense reflections: 0.2137
• Weighted residual factors for all reflections included in the refinement: 0.2278
• Goodness-of-fit parameter for all reflections included in the refinement: 1.132
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes