Information card for entry 1558293

Structure parameters

• Chemical name: PrL
• Formula: C26 H23 F6 N9 O6 P Pr
• Calculated formula: C26 H23 F6 N9 O6 P Pr
• SMILES: [Pr]1234567(ON(=O)=[O]1)(ON(=[O]3)=O)[n]1c(C=[N]2CC[N]7=Cc2[n]5c(c3[n]4cccc3)ccc2)cccc1c1[n]6cccc1.N#CC.[P](F)(F)(F)(F)(F)[F-]
• Title of publication: Aspects of lanthanide complexes for selectivity, intensity and sharpness in luminescence bands from twenty-four praseodymium, europium and gadolinium complexes with differently distorted-hexadentate ligands.
• Authors of publication: Hasegawa, Miki; Sakurai, Shoya; Yamaguchi, Masafumi Andrew; Iwasawa, Daichi; Yajima, Naho; Ogata, Shuhei; Inazuka, Yudai; Ishii, Ayumi; Suzuki, Kengo
• Journal of publication: Photochemical & photobiological sciences : Official journal of the European Photochemistry Association and the European Society for Photobiology
• Year of publication: 2020
• Journal volume: 19
• Journal issue: 8
• Pages of publication: 1054 - 1062
• a: 8.9374 ± 0.0005 Å
• b: 12.2439 ± 0.0006 Å
• c: 16.3426 ± 0.0009 Å
• α: 110.156 ± 0.001°
• β: 105.64°
• γ: 92.586 ± 0.001°
• Cell volume: 1597.71 ± 0.15 ų
• Cell temperature: 90 K
• Ambient diffraction temperature: 90 K
• Number of distinct elements: 7
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0302
• Residual factor for significantly intense reflections: 0.0295
• Weighted residual factors for significantly intense reflections: 0.0814
• Weighted residual factors for all reflections included in the refinement: 0.0819
• Goodness-of-fit parameter for all reflections included in the refinement: 1.075
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No