Information card for entry 7159940

Structure parameters

• Formula: C31 H24 N2 O6
• Calculated formula: C31 H24 N2 O6
• SMILES: O=C1N(C(=O)c2c3c1cccc3ccc2)[C@H](C(=O)OC)CCCCN1C(=O)c2c3c(C1=O)cccc3ccc2
• Title of publication: Circularly polarised luminescence from intramolecular excimer emission of bis-1,8-naphthalimide derivatives.
• Authors of publication: Eguchi, Shiori; Naoe, Mami; Kageyama, Asako; Imai, Yoshitane; Tohnai, Norimitsu; Yamazaki, Shoko; Nakata, Eiji; Takashima, Hiroshi
• Journal of publication: Organic & biomolecular chemistry
• Year of publication: 2024
• Journal volume: 22
• Journal issue: 21
• Pages of publication: 4318 - 4325
• a: 7.4391 ± 0.0003 Å
• b: 15.3129 ± 0.0006 Å
• c: 10.5379 ± 0.0004 Å
• α: 90°
• β: 96.299 ± 0.003°
• γ: 90°
• Cell volume: 1193.17 ± 0.08 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 4
• Space group number: 4
• Hermann-Mauguin space group symbol: P 1 21 1
• Hall space group symbol: P 2yb
• Residual factor for all reflections: 0.0553
• Residual factor for significantly intense reflections: 0.0521
• Weighted residual factors for significantly intense reflections: 0.1308
• Weighted residual factors for all reflections included in the refinement: 0.1338
• Goodness-of-fit parameter for all reflections included in the refinement: 1.011
• Diffraction radiation wavelength: 1.54184 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No