Information card for entry 4324431

Structure parameters

• Formula: C20 H19 Cl2 P Pt S
• Calculated formula: C20 H19 Cl2 P Pt S
• SMILES: [Pt]1(Cl)(Cl)[S](c2ccccc2)CC[P]1(c1ccccc1)c1ccccc1
• Title of publication: Chelating Effect as a Driving Force for the Selective Formation of Heteroligated Pt(II) Complexes with Bidentate Phosphino-Chalcoether Ligands
• Authors of publication: Mari S. Rosen; Alexander M. Spokoyny; Charles W. Machan; Charlotte Stern; Amy Sarjeant; Chad A. Mirkin
• Journal of publication: Inorganic Chemistry
• Year of publication: 2011
• Journal volume: 50
• Pages of publication: 1411 - 1419
• a: 10.4496 ± 0.0001 Å
• b: 13.2431 ± 0.0001 Å
• c: 16.3422 ± 0.0002 Å
• α: 113.492 ± 0.001°
• β: 103.495 ± 0.001°
• γ: 94.164 ± 0.001°
• Cell volume: 1981.72 ± 0.04 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 6
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.025
• Residual factor for significantly intense reflections: 0.0209
• Weighted residual factors for significantly intense reflections: 0.051
• Weighted residual factors for all reflections included in the refinement: 0.0519
• 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