Information card for entry 7200398

Structure parameters

• Formula: C41 H40 N2 O2 Pt
• Calculated formula: C41 H40 N2 O2 Pt
• SMILES: c1cccc2c3c([Pt]4([n]12)OC(=CC(=[O]4)C)C)cc1c2ccc(cc2C(c1c3)(CC)CC)N(c1ccc(cc1)C)c1ccc(cc1)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: 9.7385 ± 0.0005 Å
• b: 11.2842 ± 0.0005 Å
• c: 31.6544 ± 0.0015 Å
• α: 90°
• β: 94.941 ± 0.001°
• γ: 90°
• Cell volume: 3465.6 ± 0.3 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: 0.0394
• Residual factor for significantly intense reflections: 0.0307
• Weighted residual factors for significantly intense reflections: 0.071
• Weighted residual factors for all reflections included in the refinement: 0.0742
• Goodness-of-fit parameter for all reflections included in the refinement: 1.082
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No