Information card for entry 2213381

Structure parameters

• Common name: 2,2'-[(1,3-propylene)dioxybis(nitrilomethylidyne)]diphenol
• Chemical name: 2,2'-[(Propane-1,3-diyldioxy)bis(nitrilomethylidyne)]diphenol
• Formula: C17 H18 N2 O4
• Calculated formula: C17 H18 N2 O4
• Title of publication: 2,2'-[(Propane-1,3-diyldioxy)bis(nitrilomethylidyne)]diphenol
• Authors of publication: Jin-Gui Duan; Chen-Ming Dong; Jun-Yan Shi; Lei Wu; Wen-Kui Dong
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2007
• Journal volume: 63
• Journal issue: 5
• Pages of publication: o2704 - o2705
• a: 6.285 ± 0.002 Å
• b: 26.91 ± 0.003 Å
• c: 4.78 ± 0.002 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 808.4 ± 0.4 ų
• Cell temperature: 298 ± 2 K
• Ambient diffraction temperature: 298 ± 2 K
• Number of distinct elements: 4
• Space group number: 34
• Hermann-Mauguin space group symbol: P n n 2
• Hall space group symbol: P 2 -2n
• Residual factor for all reflections: 0.0522
• Residual factor for significantly intense reflections: 0.0375
• Weighted residual factors for significantly intense reflections: 0.0953
• Weighted residual factors for all reflections included in the refinement: 0.1084
• Goodness-of-fit parameter for all reflections included in the refinement: 1.025
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes