Information card for entry 4345712

Structure parameters

• Formula: C36 H22 Cl2 F10 Ir N6 P Pt
• Calculated formula: C36 H22 Cl2 F10 Ir N6 P Pt
• SMILES: [Pt]1([n]2cc[n]3[Ir]45([n]6c(c7c4cc(F)cc7F)cccc6)([n]4c(c6c5cc(F)cc6F)cccc4)[n]4ccccc4c3c2c2[n]1cccc2)(Cl)Cl.[P](F)(F)(F)(F)(F)[F-]
• Title of publication: Photophysics and Excited-State Properties of Cyclometalated Iridium(III)-Platinum(II) and Iridium(III)-Iridium(III) Bimetallic Complexes Bridged by Dipyridylpyrazine.
• Authors of publication: Cho, Yang-Jin; Kim, So-Yoen; Choi, Chang Min; Kim, Nam Joon; Kim, Chul Hoon; Cho, Dae Won; Son, Ho-Jin; Pac, Chyongjin; Kang, Sang Ook
• Journal of publication: Inorganic chemistry
• Year of publication: 2017
• Journal volume: 56
• Journal issue: 9
• Pages of publication: 5305 - 5315
• a: 10.178 ± 0.004 Å
• b: 12.83 ± 0.005 Å
• c: 19.363 ± 0.008 Å
• α: 73.797 ± 0.008°
• β: 88.454 ± 0.007°
• γ: 81.239 ± 0.008°
• Cell volume: 2399.4 ± 1.7 ų
• Cell temperature: 298 ± 2 K
• Ambient diffraction temperature: 298 ± 2 K
• Number of distinct elements: 8
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.1706
• Residual factor for significantly intense reflections: 0.0629
• Weighted residual factors for significantly intense reflections: 0.155
• Weighted residual factors for all reflections included in the refinement: 0.1946
• Goodness-of-fit parameter for all reflections included in the refinement: 0.957
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No