Information card for entry 7031169

Structure parameters

• Formula: C21 H14 Cl2 F6 N3 Pt Sb
• Calculated formula: C21 H14 Cl2 F6 N3 Pt Sb
• SMILES: [Pt]12(Cl)[n]3ccccc3c3cc(cc([n]13)c1[n]2cccc1)c1ccccc1Cl.[Sb](F)(F)(F)(F)(F)[F-]
• Title of publication: Temperature dependence of the crystal structure and luminescence properties of [Pt{4′-(o-ClC6H4)trpy}Cl]SbF6 (trpy = 2,2′:6′,2″-terpyridine)Electronic supplementary information (ESI) available: Fig. S1: Unit cell contents of [Pt{4′-(o-ClC6H4)trpy}Cl]SbF6 viewed down the [a]-axis and Fig. S2: View of the cation stack in [Pt{4′-(o-ClC6H4)trpy}Cl]SbF6. See http://www.rsc.org/suppdata/dt/b2/b209754k/
• Authors of publication: Field, John S.; Gertenbach, Jan-Andre; Haines, Raymond J.; Ledwaba, Lesibana P.; Mashapa, Ndoda T.; McMillin, David R.; Munro, Orde Q.; Summerton, Grant C.
• Journal of publication: Dalton Transactions
• Year of publication: 2003
• Journal issue: 6
• Pages of publication: 1176
• a: 6.844 ± 0.001 Å
• b: 18.965 ± 0.002 Å
• c: 18.333 ± 0.003 Å
• α: 90°
• β: 90.05 ± 0.01°
• γ: 90°
• Cell volume: 2379.6 ± 0.6 ų
• Cell temperature: 295 ± 2 K
• Ambient diffraction temperature: 295 ± 2 K
• Number of distinct elements: 7
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/n 1
• Hall space group symbol: -P 2yn
• Residual factor for all reflections: 0.0489
• Residual factor for significantly intense reflections: 0.0368
• Weighted residual factors for significantly intense reflections: 0.1079
• Weighted residual factors for all reflections included in the refinement: 0.1166
• Goodness-of-fit parameter for all reflections included in the refinement: 0.91
• Diffraction radiation wavelength: 0.7093 Å
• Diffraction radiation type: MoKa
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No