Information card for entry 2235620

Structure parameters

• Chemical name: (<i>E</i>,<i>E</i>)-1,2-Bis[3-(prop-2-yn-1-yloxy)benzylidene]hydrazine
• Formula: C20 H16 N2 O2
• Calculated formula: C20 H16 N2 O2
• SMILES: C#CCOc1cccc(c1)/C=N/N=C/c1cccc(c1)OCC#C
• Title of publication: (<i>E</i>,<i>E</i>)-1,2-Bis[3-(prop-2-yn-1-yloxy)benzylidene]hydrazine
• Authors of publication: Al-Mehana, Wisam Naji Atiyah; Yahya, Rosiyah; Sonsudin, Faridah; Lo, Kong Mun
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2012
• Journal volume: 68
• Journal issue: 7
• Pages of publication: o2087
• a: 4.57 ± 0.0003 Å
• b: 9.4947 ± 0.0007 Å
• c: 9.892 ± 0.0008 Å
• α: 67.986 ± 0.007°
• β: 77.487 ± 0.006°
• γ: 84.132 ± 0.006°
• Cell volume: 388.37 ± 0.05 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 4
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0478
• Residual factor for significantly intense reflections: 0.0407
• Weighted residual factors for significantly intense reflections: 0.1141
• Weighted residual factors for all reflections included in the refinement: 0.1217
• Goodness-of-fit parameter for all reflections included in the refinement: 1.016
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes