Information card for entry 2232502

Structure parameters

• Chemical name: (<i>E</i>,<i>E</i>)-1,2-Bis[4-(prop-2-yn-1-yloxy)benzylidene]hydrazine
• Formula: C20 H16 N2 O2
• Calculated formula: C20 H16 N2 O2
• SMILES: C#CCOc1ccc(cc1)/C=N/N=C/c1ccc(cc1)OCC#C
• Title of publication: (<i>E</i>,<i>E</i>)-1,2-Bis[4-(prop-2-yn-1-yloxy)benzylidene]hydrazine
• Authors of publication: Al-Mehana, Wisam Naji Atiyah; Yahya, Rosiyah; Lo, Kong Mun
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2011
• Journal volume: 67
• Journal issue: 11
• Pages of publication: o2900
• a: 7.6598 ± 0.0001 Å
• b: 8.1117 ± 0.0001 Å
• c: 12.9966 ± 0.0002 Å
• α: 90°
• β: 94.466 ± 0.001°
• γ: 90°
• Cell volume: 805.079 ± 0.019 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 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: 0.0397
• Residual factor for significantly intense reflections: 0.0371
• Weighted residual factors for significantly intense reflections: 0.1073
• Weighted residual factors for all reflections included in the refinement: 0.1112
• Goodness-of-fit parameter for all reflections included in the refinement: 1.005
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes