Information card for entry 2222341

Structure parameters

• Chemical name: 2,2'-[1,1'-(Ethylenedioxydinitrilo)diethylidyne]di-1-naphthol
• Formula: C26 H24 N2 O4
• Calculated formula: C26 H24 N2 O4
• SMILES: CC(=N\OCCO/N=C(/c1ccc2c(c1O)cccc2)C)/c1ccc2c(c1O)cccc2
• Title of publication: 2,2'-[1,1'-(Ethylenedioxydinitrilo)diethylidyne]di-1-naphthol
• Authors of publication: Dong, Wen-Kui; Wu, Jian-chao; Yao, Jian; Li, Li; Gong, Shang-sheng
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2009
• Journal volume: 65
• Journal issue: 7
• Pages of publication: o1598
• a: 12.6682 ± 0.0018 Å
• b: 9.3728 ± 0.0015 Å
• c: 18.335 ± 0.002 Å
• α: 90°
• β: 97.478 ± 0.002°
• γ: 90°
• Cell volume: 2158.5 ± 0.5 ų
• Cell temperature: 298 ± 2 K
• Ambient diffraction temperature: 298 ± 2 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: 0.0991
• Residual factor for significantly intense reflections: 0.0445
• Weighted residual factors for significantly intense reflections: 0.0957
• Weighted residual factors for all reflections included in the refinement: 0.1215
• Goodness-of-fit parameter for all reflections included in the refinement: 1.058
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes