Information card for entry 7021516

Structure parameters

• Formula: C26 H24 Br2 N4
• Calculated formula: C26 H24 Br2 N4
• SMILES: c1n(c2ccc(cc2)n2c[n+](cc2)Cc2ccccc2)cc[n+]1Cc1ccccc1.[Br-].[Br-]
• Title of publication: (C^C*) Cyclometalated binuclear N-heterocyclic biscarbene platinum(ii) complexes - highly emissive phosphorescent emitters.
• Authors of publication: Tronnier, Alexander; Strassner, Thomas
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2013
• Journal volume: 42
• Journal issue: 27
• Pages of publication: 9847 - 9851
• a: 12.301 ± 0.003 Å
• b: 8.981 ± 0.0018 Å
• c: 11.865 ± 0.002 Å
• α: 90°
• β: 112.87 ± 0.03°
• γ: 90°
• Cell volume: 1207.7 ± 0.5 ų
• Cell temperature: 198 K
• Ambient diffraction temperature: 198 K
• Number of distinct elements: 4
• 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: 0.0685
• Residual factor for significantly intense reflections: 0.0359
• Weighted residual factors for significantly intense reflections: 0.0683
• Weighted residual factors for all reflections included in the refinement: 0.079
• Goodness-of-fit parameter for all reflections included in the refinement: 1.051
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No