Information card for entry 1557420

Structure parameters

• Common name: Bu4N[Pt(ppy)Cl2]
• Formula: C27 H44 Cl2 N2 Pt
• Calculated formula: C27 Cl2 N2 Pt
• SMILES: [Pt]1(c2c(c3[n]1cccc3)cccc2)(Cl)Cl.[N+](CCCC)(CCCC)(CCCC)CCCC
• Title of publication: Crystal Structures of Bu4N[Pt(ppy)Cl2], Et4N[Pt(tpy)Cl2] and [Pt(ppy)en]Cl (ppy = N,C'-Chelated 2-Phenylpyridinate, tpy = N,C'-Chelated 2-(2'-Thienyl)pyridinate, en = N,N'-Chelated 1,2-Diaminoethane).
• Authors of publication: Kvam, Per-Inge; Engebretsen, Thoralf; Maartmann-Moe, Knut; Songstad, Jon
• Journal of publication: Acta Chemica Scandinavica
• Year of publication: 1996
• Journal volume: 50
• Pages of publication: 107 - 113
• a: 11.551 ± 0.002 Å
• b: 16.759 ± 0.005 Å
• c: 14.541 ± 0.009 Å
• α: 90°
• β: 98.68 ± 0.03°
• γ: 90°
• Cell volume: 2783 ± 2 ų
• Ambient diffraction temperature: 93 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 significantly intense reflections: 0.038
• Weighted residual factors for significantly intense reflections: 0.031
• Goodness-of-fit parameter for all reflections included in the refinement: 1.405
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 0.71069 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No