Information card for entry 1557715

Structure parameters

• Common name: trans-N,P-[Pt(tpy)(Pmor3)Cl].CH3CN
• Formula: C23 H36 Cl N5 O3 P Pt S
• Calculated formula: C23 Cl N5 O3 P Pt S
• SMILES: [Pt]1(c2c(c3[n]1cccc3)scc2)(Cl)[P](N1CCOCC1)(N1CCOCC1)N1CCOCC1.N#CC
• Title of publication: Crystal Structures and Spectroscopic Properties of trans-N,P-[Pt(ppy)(Pmor3)Cl] and trans-N,P-[Pt(tpy)(Pmor3)Cl].CH3CN [ppy = N,C'-chelated 2-phenylpyridinate, tpy = N,C'-Chelated 2-(2'-thienyl)pyridinate, Pmor3 = tris(morpholino)phosphine]
• Authors of publication: Balashev, Konstantin P.; Engebretsen, Thoralf; Kvam, Per-Inge; Maartmann-Moe, Knut; Puzyk, Michael V.; Songstad, Jon
• Journal of publication: Acta Chemica Scandinavica
• Year of publication: 1996
• Journal volume: 50
• Pages of publication: 1108 - 1115
• a: 12.415 ± 0.004 Å
• b: 12.731 ± 0.001 Å
• c: 16.702 ± 0.006 Å
• α: 90°
• β: 105.42 ± 0.02°
• γ: 90°
• Cell volume: 2544.8 ± 1.3 ų
• Ambient diffraction temperature: 93 K
• Number of distinct elements: 8
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/a 1
• Hall space group symbol: -P 2yab
• Residual factor for significantly intense reflections: 0.026
• Weighted residual factors for significantly intense reflections: 0.033
• Goodness-of-fit parameter for all reflections included in the refinement: 1.626
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No