Information card for entry 7118514

Structure parameters

• Formula: C23 H15 Cl F4 N2 Pt
• Calculated formula: C23 H15 Cl F4 N2 Pt
• SMILES: [Pt]12(Cl)(C)([n]3c(c4c2cc(F)cc4F)cccc3)[n]2c(c3c1cc(cc3F)F)cccc2
• Title of publication: Developing strongly luminescent platinum(iv) complexes: facile synthesis of bis-cyclometalated neutral emitters.
• Authors of publication: Juliá, Fabio; Bautista, Delia; González-Herrero, Pablo
• Journal of publication: Chemical communications (Cambridge, England)
• Year of publication: 2016
• Journal volume: 52
• Journal issue: 8
• Pages of publication: 1657 - 1660
• a: 8.87 ± 0.0005 Å
• b: 10.7659 ± 0.0006 Å
• c: 12.1232 ± 0.0006 Å
• α: 99.7042 ± 0.0016°
• β: 109.505 ± 0.0015°
• γ: 104.886 ± 0.0016°
• Cell volume: 1012.69 ± 0.1 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 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: 0.0182
• Residual factor for significantly intense reflections: 0.0162
• Weighted residual factors for significantly intense reflections: 0.0383
• Weighted residual factors for all reflections included in the refinement: 0.0388
• Goodness-of-fit parameter for all reflections included in the refinement: 1.078
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No