Information card for entry 7203293

Structure parameters

• Formula: C26 H14 N2 O4
• Calculated formula: C26 H14 N2 O4
• SMILES: C1(=O)c2c3c(C(=O)N1c1ccccc1)ccc1C(=O)N(C(=O)c(c31)cc2)c1ccccc1
• Title of publication: 1,4;5,8-naphthalene-tetracarboxylic diimide derivatives as model compounds for molecular layer epitaxy
• Authors of publication: Ofir, Yuval; Zelichenok, Alexander; Yitzchaik, Shlomo
• Journal of publication: Journal of Materials Chemistry
• Year of publication: 2006
• Journal volume: 16
• Journal issue: 22
• Pages of publication: 2142
• a: 5.136 ± 0.0006 Å
• b: 7.5227 ± 0.0008 Å
• c: 25.623 ± 0.003 Å
• α: 90°
• β: 91.005 ± 0.002°
• γ: 90°
• Cell volume: 989.83 ± 0.19 ų
• Cell temperature: 295 ± 1 K
• Ambient diffraction temperature: 295 ± 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: 0.1313
• Residual factor for significantly intense reflections: 0.0644
• Weighted residual factors for significantly intense reflections: 0.1037
• Weighted residual factors for all reflections included in the refinement: 0.125
• Goodness-of-fit parameter for all reflections included in the refinement: 1.013
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No