Information card for entry 4310215

Structure parameters

• Chemical name: 1-(4-biphenyl)-3,5-di(2-pyridyl)benzene platinum(II) chloride
• Formula: C30 H21 Cl7 N2 Pt
• Calculated formula: C30 H21 Cl7 N2 Pt
• SMILES: [Pt]12(c3c(c4[n]1cccc4)cc(c1ccc(c4ccccc4)cc1)cc3c1[n]2cccc1)Cl.ClC(Cl)Cl.ClC(Cl)Cl
• Title of publication: Controlling Emission Energy, Self-Quenching, and Excimer Formation in Highly Luminescent N^C^N-Coordinated Platinum(II) Complexes
• Authors of publication: Sarah J. Farley; David L. Rochester; Amber L. Thompson; Judith A. K. Howard; J. A. Gareth Williams
• Journal of publication: Inorganic Chemistry
• Year of publication: 2005
• Journal volume: 44
• Pages of publication: 9690 - 9703
• a: 17.0006 ± 0.0009 Å
• b: 21.0713 ± 0.0011 Å
• c: 9.307 ± 0.0005 Å
• α: 90°
• β: 114.122 ± 0.001°
• γ: 90°
• Cell volume: 3042.9 ± 0.3 ų
• Cell temperature: 120 ± 2 K
• Ambient diffraction temperature: 120 ± 2 K
• Number of distinct elements: 5
• Space group number: 15
• Hermann-Mauguin space group symbol: C 1 2/c 1
• Hall space group symbol: -C 2yc
• Residual factor for all reflections: 0.0223
• Residual factor for significantly intense reflections: 0.0186
• Weighted residual factors for significantly intense reflections: 0.0462
• Weighted residual factors for all reflections included in the refinement: 0.0477
• Goodness-of-fit parameter for all reflections included in the refinement: 1.051
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No