Information card for entry 7000795

Structure parameters

• Common name: Compound X
• Formula: C55 H34 Cl2 N6 Pt2 Tl2
• Calculated formula: C55 H34 Cl2 N6 Pt2 Tl2
• Title of publication: Extended structures containing Pt(ii)‒Tl(i) bonds. Effect of these interactions on the luminescence of cyclometalated Pt(ii) compounds
• Authors of publication: Forniés, Juan; Fuertes, Sara; Martín, Antonio; Sicilia, Violeta; Gil, Belén; Lalinde, Elena
• Journal of publication: Dalton Transactions
• Year of publication: 2009
• Journal issue: 12
• Pages of publication: 2224 - 2234
• a: 22.103 ± 0.0011 Å
• b: 8.667 ± 0.0005 Å
• c: 24.301 ± 0.0014 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 4655.3 ± 0.4 ų
• Cell temperature: 173 ± 2 K
• Ambient diffraction temperature: 173 ± 2 K
• Number of distinct elements: 6
• Space group number: 60
• Hermann-Mauguin space group symbol: P b c n
• Hall space group symbol: -P 2n 2ab
• Residual factor for all reflections: 0.1362
• Residual factor for significantly intense reflections: 0.0707
• Weighted residual factors for significantly intense reflections: 0.149
• Weighted residual factors for all reflections included in the refinement: 0.1749
• Goodness-of-fit parameter for all reflections included in the refinement: 1.09
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No