Information card for entry 7135887

Structure parameters

• Formula: C56 H38 Cl4 N6 Pt2 S6
• Calculated formula: C54 H34 N6 Pt2 S6
• Title of publication: Unlocking efficient near-infrared circularly polarized phosphorescence reaching 800 nm in cyclometalated Pt(II) complexes.
• Authors of publication: Gu, Shilin; Li, Dongsheng; Long, Deng; Yu, Xinglin; Li, Wentao; Ma, Sihan; Tao, Peng
• Journal of publication: Chemical communications (Cambridge, England)
• Year of publication: 2026
• Journal volume: 62
• Journal issue: 39
• Pages of publication: 9904 - 9908
• a: 12.6435 ± 0.0011 Å
• b: 19.402 ± 0.002 Å
• c: 22.375 ± 0.003 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 5488.8 ± 1 ų
• Cell temperature: 200 K
• Ambient diffraction temperature: 200 K
• Number of distinct elements: 6
• Space group number: 19
• Hermann-Mauguin space group symbol: P 21 21 21
• Hall space group symbol: P 2ac 2ab
• Residual factor for all reflections: 0.0449
• Residual factor for significantly intense reflections: 0.0362
• Weighted residual factors for significantly intense reflections: 0.0839
• Weighted residual factors for all reflections included in the refinement: 0.0877
• Goodness-of-fit parameter for all reflections included in the refinement: 1.005
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No