Information card for entry 1568788

Structure parameters

• Formula: C28 H34 N2 O4
• Calculated formula: C28 H34 N2 O4
• Title of publication: Synthesis, Solution, and Solid State Properties of Homological Dialkylated Naphthalene Diimides—A Systematic Review of Molecules for Next-Generation Organic Electronics
• Authors of publication: Chlebosz, Dorota; Goldeman, Waldemar; Janus, Krzysztof; Szuster, Michał; Kiersnowski, Adam
• Journal of publication: Molecules
• Year of publication: 2023
• Journal volume: 28
• Journal issue: 7
• Pages of publication: 2940
• a: 7.873 ± 0.0002 Å
• b: 4.84356 ± 0.00013 Å
• c: 33.0246 ± 0.0009 Å
• α: 90°
• β: 95.025 ± 0.003°
• γ: 90°
• Cell volume: 1254.5 ± 0.06 ų
• Cell temperature: 295 K
• Ambient diffraction temperature: 295 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: 0.0565
• Residual factor for significantly intense reflections: 0.0463
• Weighted residual factors for significantly intense reflections: 0.1128
• Weighted residual factors for all reflections included in the refinement: 0.1182
• Goodness-of-fit parameter for all reflections included in the refinement: 1.096
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No