Information card for entry 7056041

Structure parameters

• Formula: C20 H22 N P Pt S
• Calculated formula: C20 H22 N P Pt S
• SMILES: [PtH]1([P](c2ccccc2)(c2ccccc2)c2ccccc2)SCC[NH2]1
• Title of publication: Tuning diastereoisomerism in platinum(ii) phosphino- and aminothiolato hydrido complexes
• Authors of publication: Polo, A.; Duran, J.; Juanola, R.; Real, J.; Benet-Buchholz, J.; Solà, M.; Poater, A.
• Journal of publication: New J. Chem.
• Year of publication: 2017
• Journal volume: 41
• Journal issue: 8
• Pages of publication: 3015
• a: 11.2021 ± 0.0006 Å
• b: 8.9266 ± 0.0005 Å
• c: 19.0001 ± 0.001 Å
• α: 90°
• β: 90.03 ± 0.002°
• γ: 90°
• Cell volume: 1899.95 ± 0.18 ų
• Cell temperature: 153 ± 2 K
• Ambient diffraction temperature: 153 ± 2 K
• Number of distinct elements: 6
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/c 1
• Hall space group symbol: -P 2ybc
• Residual factor for all reflections: 0.0583
• Residual factor for significantly intense reflections: 0.0411
• Weighted residual factors for significantly intense reflections: 0.0909
• Weighted residual factors for all reflections included in the refinement: 0.0968
• Goodness-of-fit parameter for all reflections included in the refinement: 0.981
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No