Information card for entry 7200399

Structure parameters

• Formula: C27 H27 N O2 Pt
• Calculated formula: C27 H27 N O2 Pt
• SMILES: CC1=CC(=[O][Pt]2(O1)c1c(c3cccc[n]23)cc2c(c1)c1ccccc1C2(CC)CC)C
• Title of publication: A versatile color tuning strategy for iridium(III) and platinum(II) electrophosphors by shifting the charge-transfer states with an electron-deficient core
• Authors of publication: Zhou, Gui-Jiang; Wang, Qi; Wong, Wai-Yeung; Ma, Dongge; Wang, Lixiang; Lin, Zhenyang
• Journal of publication: Journal of Materials Chemistry
• Year of publication: 2009
• Journal volume: 19
• Journal issue: 13
• Pages of publication: 1872
• a: 8.1679 ± 0.0005 Å
• b: 26.7111 ± 0.0015 Å
• c: 10.9458 ± 0.0006 Å
• α: 90°
• β: 107.251 ± 0.001°
• γ: 90°
• Cell volume: 2280.7 ± 0.2 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 5
• 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: 0.0309
• Residual factor for significantly intense reflections: 0.0272
• Weighted residual factors for significantly intense reflections: 0.0616
• Weighted residual factors for all reflections included in the refinement: 0.0628
• Goodness-of-fit parameter for all reflections included in the refinement: 1.176
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No