Information card for entry 1565768

Structure parameters

• Formula: C16 H18 Cl3 N3 O Pt S
• Calculated formula: C16 H18 Cl3 N3 O Pt S
• SMILES: c1cccc2c3n(c4c(cccc4)n3)[Pt](C)([n]12)[S](C)(C)=O.C(Cl)(Cl)Cl
• Title of publication: Synthesis, structural characterization, and luminescence properties of mono- and di-nuclear platinum(II) complexes containing 2-(2-pyridyl)-benzimidazole
• Authors of publication: Niknam, Fatemeh; Hamidizadeh, Peyman; Nabavizadeh, S. Masoud; Niroomand Hosseini, Fatemeh; Hoseini, S. Jafar; Ford, Peter C.; Abu-Omar, Mahdi M.
• Journal of publication: Inorganica Chimica Acta
• Year of publication: 2019
• Journal volume: 498
• Pages of publication: 119133
• a: 28.739 ± 0.012 Å
• b: 9.095 ± 0.003 Å
• c: 15.149 ± 0.005 Å
• α: 90°
• β: 98.994 ± 0.01°
• γ: 90°
• Cell volume: 3911 ± 2 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 7
• 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: 0.0771
• Residual factor for significantly intense reflections: 0.0458
• Weighted residual factors for significantly intense reflections: 0.1078
• Weighted residual factors for all reflections included in the refinement: 0.1281
• Goodness-of-fit parameter for all reflections included in the refinement: 0.845
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No