Information card for entry 2013536

Structure parameters

• Chemical name: Bromotris(dimethyl sulfide-κS)platinum(II) hexafluorophosphate
• Formula: C6 H18 Br F6 P Pt S3
• Calculated formula: C6 H18 Br F6 P Pt S3
• SMILES: [Pt](Br)([S](C)C)([S](C)C)[S](C)C.[P](F)(F)(F)(F)(F)[F-]
• Title of publication: Hexafluorophosphates of chlorotris(dimethyl sulfide)platinum(II) and bromotris(dimethyl sulfide)platinum(II)
• Authors of publication: Hansson, Christian; Kukushkin, Vadim Yu.; Lövqvist, Karin; Yong, Shen; Oskarsson, Åke
• Journal of publication: Acta Crystallographica Section C
• Year of publication: 2003
• Journal volume: 59
• Journal issue: 11
• Pages of publication: m432 - m434
• a: 8.5981 ± 0.0004 Å
• b: 23.9384 ± 0.001 Å
• c: 8.3852 ± 0.0003 Å
• α: 90°
• β: 104.235 ± 0.001°
• γ: 90°
• Cell volume: 1672.89 ± 0.12 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 7
• 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: 0.0909
• Residual factor for significantly intense reflections: 0.0449
• Weighted residual factors for significantly intense reflections: 0.0866
• Weighted residual factors for all reflections included in the refinement: 0.0959
• Goodness-of-fit parameter for all reflections included in the refinement: 1.011
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes