Information card for entry 7134652

Structure parameters

• Chemical name: LKI1087-10
• Formula: C28 H34 I2 N2 O2
• Calculated formula: C28 H34 I2 N2 O2
• Title of publication: Polysubstitution of dipyrrolonaphthyridinediones as a potent strategy towards strongly emitting fluorophores
• Authors of publication: Skonieczny, Kamil; Kielesiński, Łukasz; Grzybowski, Marek; Gryko, Daniel T.
• Journal of publication: Chemical Communications
• Year of publication: 2025
• Journal volume: 61
• Journal issue: 55
• Pages of publication: 10178 - 10181
• a: 31.5672 ± 0.0007 Å
• b: 4.6473 ± 0.0001 Å
• c: 18.6492 ± 0.0004 Å
• α: 90°
• β: 101.217 ± 0.002°
• γ: 90°
• Cell volume: 2683.62 ± 0.1 ų
• Cell temperature: 100.01 ± 0.1 K
• Ambient diffraction temperature: 100.01 ± 0.1 K
• Number of distinct elements: 5
• 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: 0.0662
• Residual factor for significantly intense reflections: 0.0395
• Weighted residual factors for significantly intense reflections: 0.1191
• Weighted residual factors for all reflections included in the refinement: 0.1341
• Goodness-of-fit parameter for all reflections included in the refinement: 0.893
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No