Information card for entry 4128667

Structure parameters

• Formula: C28 H19 N O2 Pt S
• Calculated formula: C28 H19 N O2 Pt S
• SMILES: [Pt]12(c3c(c4[n]1cccc4)sc1ccccc31)OC(=CC(=[O]2)c1ccccc1)c1ccccc1
• Title of publication: Photoluminescent Anisotropy Amplification in Polymorphic Organic Nanocrystals by Light-Harvesting Energy Transfer.
• Authors of publication: Sun, Meng-Jia; Liu, Yingying; Zeng, Wei; Zhao, Yong Sheng; Zhong, Yu-Wu; Yao, Jiannian
• Journal of publication: Journal of the American Chemical Society
• Year of publication: 2019
• Journal volume: 141
• Journal issue: 15
• Pages of publication: 6157 - 6161
• a: 11.7362 ± 0.0019 Å
• b: 15.51 ± 0.002 Å
• c: 12.1799 ± 0.0019 Å
• α: 90°
• β: 98.288 ± 0.002°
• γ: 90°
• Cell volume: 2193.9 ± 0.6 ų
• Cell temperature: 173 ± 2 K
• Ambient diffraction temperature: 173.15 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: 0.0348
• Residual factor for significantly intense reflections: 0.0337
• Weighted residual factors for significantly intense reflections: 0.0838
• Weighted residual factors for all reflections included in the refinement: 0.0846
• Goodness-of-fit parameter for all reflections included in the refinement: 1.142
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No