Information card for entry 1557017

Structure parameters

• Formula: C40 H33 Cl P2 Pt S
• Calculated formula: C40 Cl P2 Pt S
• SMILES: [Pt](Cl)([P](c1ccccc1)(c1ccccc1)c1ccccc1)([P](c1ccccc1)(c1ccccc1)c1ccccc1)c1sccc1
• Title of publication: Crystal and Molecular Structure of trans-Chlorobis(triphenylphosphine)(2-thienyl) Platinum(II)
• Authors of publication: Oilunkaniemi, Raija; Niiranen, Marjaana; Laitinen, Risto S.; Ahlgren, Markku; Pursiainen, Jouni
• Journal of publication: Acta Chemica Scandinavica
• Year of publication: 1998
• Journal volume: 52
• Pages of publication: 1068 - 1070
• a: 12.139 ± 0.002 Å
• b: 12.706 ± 0.003 Å
• c: 13.335 ± 0.003 Å
• α: 90.44 ± 0.03°
• β: 115 ± 0.03°
• γ: 108.81 ± 0.03°
• Cell volume: 1739.5 ± 0.9 ų
• Ambient diffraction temperature: 293 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: 0.0698
• Residual factor for significantly intense reflections: 0.052
• Weighted residual factors for significantly intense reflections: 0.1221
• Weighted residual factors for all reflections included in the refinement: 0.1258
• Goodness-of-fit parameter for all reflections included in the refinement: 1.022
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No