Information card for entry 7720474

Structure parameters

• Formula: C150 H172 Cl8 Ir2 N12
• Calculated formula: C146 H164 Ir2 N12
• Title of publication: Janus-type diiridium complexes with functional carbene cyclometalates for high-energy phosphorescence.
• Authors of publication: Ni, Guowei; Pan, Yi; Zhou, Muyu; Sang, Yufeng; Yiu, Shek-Man; Lau, Kai Chung; Chi, Yun
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2026
• Journal volume: 55
• Journal issue: 2
• Pages of publication: 904 - 916
• a: 33.7477 ± 0.0018 Å
• b: 12.4772 ± 0.0007 Å
• c: 33.9723 ± 0.0018 Å
• α: 90°
• β: 95.452 ± 0.003°
• γ: 90°
• Cell volume: 14240.2 ± 1.3 ų
• Cell temperature: 213 ± 2 K
• Ambient diffraction temperature: 213 ± 2 K
• Number of distinct elements: 5
• Space group number: 13
• Hermann-Mauguin space group symbol: P 1 2/n 1
• Hall space group symbol: -P 2yac
• Residual factor for all reflections: 0.1028
• Residual factor for significantly intense reflections: 0.0692
• Weighted residual factors for significantly intense reflections: 0.1755
• Weighted residual factors for all reflections included in the refinement: 0.1951
• Goodness-of-fit parameter for all reflections included in the refinement: 1.07
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 1.54178 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No