Information card for entry 7031096

Structure parameters

• Formula: C30 H23 N3 Pt
• Calculated formula: C30 H23 N3 Pt
• SMILES: [Pt]1([n]2c(c3[n]1c1c(n3CC)cccc1)cccc2)(C#Cc1ccccc1)C#Cc1ccccc1
• Title of publication: Complexes of substituted derivatives of 2-(2-pyridyl)benzimidazole with Re(I), Ru(II) and Pt(II): structures, redox and luminescence properties.
• Authors of publication: Shavaleev, Nail M.; Bell, Zöe R; Easun, Timothy L.; Rutkaite, Ramune; Swanson, Linda; Ward, Michael D.
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2004
• Journal issue: 21
• Pages of publication: 3678 - 3688
• a: 13.435 ± 0.004 Å
• b: 7.5867 ± 0.0013 Å
• c: 23.436 ± 0.005 Å
• α: 90°
• β: 105.215 ± 0.014°
• γ: 90°
• Cell volume: 2305 ± 0.9 ų
• Cell temperature: 173 ± 2 K
• Ambient diffraction temperature: 173 ± 2 K
• Number of distinct elements: 4
• 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: 0.0524
• Residual factor for significantly intense reflections: 0.0335
• Weighted residual factors for significantly intense reflections: 0.0696
• Weighted residual factors for all reflections included in the refinement: 0.0763
• Goodness-of-fit parameter for all reflections included in the refinement: 1.012
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No