Information card for entry 4082288

Structure parameters

• Formula: C13 H17 Cl F2 N2 O Pt
• Calculated formula: C13 H17 Cl F2 N2 O Pt
• SMILES: [Pt]12(c3c(C=[N]2CCC[N]1(C)C)c(OC)c(F)c(F)c3)Cl
• Title of publication: Platinum(II) Compounds Containing Cyclometalated Tridentate Ligands: Synthesis, Luminescence Studies, and a Selective Fluoro for Methoxy Substitution
• Authors of publication: Gandioso, Albert; Valle-Sistac, Jennifer; Rodr\?íguez, Laura; Crespo, Margarita; Font-Bard\?ía, Mercè
• Journal of publication: Organometallics
• Year of publication: 2014
• Journal volume: 33
• Journal issue: 2
• Pages of publication: 561
• a: 6.3309 ± 0.0004 Å
• b: 11.8103 ± 0.0007 Å
• c: 19.2021 ± 0.0011 Å
• α: 90°
• β: 98.104 ± 0.002°
• γ: 90°
• Cell volume: 1421.4 ± 0.15 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 7
• 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: 0.038
• Residual factor for significantly intense reflections: 0.0258
• Weighted residual factors for significantly intense reflections: 0.0486
• Weighted residual factors for all reflections included in the refinement: 0.0528
• Goodness-of-fit parameter for all reflections included in the refinement: 0.985
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No