Information card for entry 1565769

Structure parameters

• Formula: C52 H42 N6 P2 Pt2
• Calculated formula: C52 H42 N6 P2 Pt2
• SMILES: c12c3cccc[n]3[Pt](n1c1ccccc1n2)([P](C#C[P](c1ccccc1)(c1ccccc1)[Pt]1([n]2c(c3n1c1ccccc1n3)cccc2)C)(c1ccccc1)c1ccccc1)C
• 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: 8.275 ± 0.005 Å
• b: 25.122 ± 0.014 Å
• c: 10.608 ± 0.008 Å
• α: 90°
• β: 97.94 ± 0.03°
• γ: 90°
• Cell volume: 2184 ± 2 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 5
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/n 1
• Hall space group symbol: -P 2yn
• Residual factor for all reflections: 0.0653
• Residual factor for significantly intense reflections: 0.0418
• Weighted residual factors for significantly intense reflections: 0.0843
• Weighted residual factors for all reflections included in the refinement: 0.0931
• Goodness-of-fit parameter for all reflections included in the refinement: 1.019
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No