Information card for entry 7002471

Structure parameters

• Common name: (Pt(9S3)(SbPH3)2)(PF6)2
• Formula: C44 H48 F12 N2 O4 P2 Pt S3 Sb2
• Calculated formula: C44 H48 F12 N2 O4 P2 Pt S3 Sb2
• SMILES: [Pt]12([Sb](c3ccccc3)(c3ccccc3)c3ccccc3)([Sb](c3ccccc3)(c3ccccc3)c3ccccc3)[S]3CC[S]1CC[S]2CC3.[P](F)(F)(F)(F)(F)[F-].[P](F)(F)(F)(F)(F)[F-].N(=O)(=O)C.N(=O)(=O)C
• Title of publication: Thiacrown PtII complexes with group 15 donor ligands: pentacoordination in Pt(II) complexes
• Authors of publication: Grant, Gregory J.; Benefield, Desirée A.; VanDerveer, Donald G.
• Journal of publication: Dalton Transactions
• Year of publication: 2009
• Journal issue: 40
• Pages of publication: 8605 - 8615
• a: 12.893 ± 0.003 Å
• b: 13.11 ± 0.003 Å
• c: 15.374 ± 0.003 Å
• α: 93.67 ± 0.03°
• β: 93.94 ± 0.03°
• γ: 91.84 ± 0.03°
• Cell volume: 2585.4 ± 1 ų
• Cell temperature: 163 ± 2 K
• Ambient diffraction temperature: 163 ± 2 K
• Number of distinct elements: 9
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0406
• Residual factor for significantly intense reflections: 0.0341
• Weighted residual factors for significantly intense reflections: 0.0729
• Weighted residual factors for all reflections included in the refinement: 0.0773
• Goodness-of-fit parameter for all reflections included in the refinement: 1.083
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No