Information card for entry 7024433

Structure parameters

• Common name: [Pt(trpy)(NCS)]SbF6.CH3CN
• Formula: C18 H14 F6 N5 Pt S Sb
• Calculated formula: C18 H14 F6 N5 Pt S Sb
• SMILES: [Pt]12([n]3ccccc3c3cccc([n]13)c1cccc[n]21)N=C=S.[Sb](F)(F)(F)(F)(F)[F-].N#CC
• Title of publication: Speciation in solution, solid state spectroscopy and vapochromism of [Pt(trpy)(NCS)]SbF(6) where trpy = 2,2':6',2''-terpyridine.
• Authors of publication: Field, John S.; Grimmer, Craig D.; Munro, Orde Q.; Waldron, Bradley P.
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2010
• Journal volume: 39
• Journal issue: 6
• Pages of publication: 1558 - 1567
• a: 7.221 ± 0.002 Å
• b: 12.271 ± 0.003 Å
• c: 13.469 ± 0.004 Å
• α: 109.773 ± 0.018°
• β: 95.37 ± 0.016°
• γ: 102.289 ± 0.013°
• Cell volume: 1079.4 ± 0.5 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 7
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0446
• Residual factor for significantly intense reflections: 0.0243
• Weighted residual factors for significantly intense reflections: 0.0333
• Weighted residual factors for all reflections included in the refinement: 0.0344
• Goodness-of-fit parameter for all reflections included in the refinement: 0.85
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No