Information card for entry 7703596

Structure parameters

• Formula: C24 H27 N O2 Pt Se
• Calculated formula: C24 H27 N O2 Pt Se
• SMILES: [Pt]12(c3c(c4[n]2cccc4)[se]c2ccccc32)OC(=CC(=[O]1)C(C)(C)C)C(C)(C)C
• Title of publication: Benzoselenophenylpyridine platinum complexes: green versus red phosphorescence towards hybrid OLEDs.
• Authors of publication: Petrenko, Alla; Leitonas, Karolis; Volyniuk, Dmytro; Baryshnikov, Gleb V.; Belyakov, Sergey; Minaev, Boris F.; Ågren, Hans; Durgaryan, Hranush; GraŽulevičius, Juozas Vidas; Arsenyan, Pavel
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2020
• Journal volume: 49
• Journal issue: 11
• Pages of publication: 3393 - 3397
• a: 17.13173 ± 0.00012 Å
• b: 5.77152 ± 0.00005 Å
• c: 23.0206 ± 0.0002 Å
• α: 90°
• β: 107.05 ± 0.0008°
• γ: 90°
• Cell volume: 2176.15 ± 0.03 ų
• Cell temperature: 160 ± 0.1 K
• Ambient diffraction temperature: 160 ± 0.1 K
• Number of distinct elements: 6
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/c 1
• Hall space group symbol: -P 2ybc
• Residual factor for all reflections: 0.0291
• Residual factor for significantly intense reflections: 0.0284
• Weighted residual factors for significantly intense reflections: 0.0779
• Weighted residual factors for all reflections included in the refinement: 0.0786
• Goodness-of-fit parameter for all reflections included in the refinement: 1.0513
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 1.54184 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No