Information card for entry 1515760

Structure parameters

• Formula: C56 H46 Cl4 N2 O0 Pt
• Calculated formula: C56 H46 Cl4 N2 Pt
• SMILES: [Pt]1([n]2c(c3[n]1ccc(c3)C(C)(C)C)cc(cc2)C(C)(C)C)(C#Cc1ccc2ccc3cccc4ccc1c2c34)C#Cc1ccc2ccc3cccc4ccc1c2c34.ClCCl.ClCCl
• Title of publication: Long-lived emissive intra-ligand triplet excited states (3IL): next generation luminescent oxygen sensing scheme and a case study with red phosphorescent diimine Pt(II) bis(acetylide) complexes containing ethynylated naphthalimide or pyrene subunits.
• Authors of publication: Guo, Huimin; Ji, Shaomin; Wu, Wanhua; Wu, Wenting; Shao, Jingyin; Zhao, Jianzhang
• Journal of publication: The Analyst
• Year of publication: 2010
• Journal volume: 135
• Journal issue: 11
• Pages of publication: 2832 - 2840
• a: 12.6641 ± 0.0015 Å
• b: 14.2389 ± 0.0017 Å
• c: 14.7922 ± 0.0017 Å
• α: 66.344 ± 0.001°
• β: 72.791 ± 0.002°
• γ: 85.566 ± 0.002°
• Cell volume: 2331.2 ± 0.5 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 6
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0524
• Residual factor for significantly intense reflections: 0.0418
• Weighted residual factors for significantly intense reflections: 0.0925
• Weighted residual factors for all reflections included in the refinement: 0.096
• Goodness-of-fit parameter for all reflections included in the refinement: 1.064
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No