Information card for entry 7718377

Structure parameters

• Formula: C102.5 H138 F6 Ir8 N16 O6 S2
• Calculated formula: C102.5 H138 F6 Ir8 N16 O6 S2
• Title of publication: Synthesis and characterization of ¹⁵N-labeled tetranuclear Ir complexes <i>via</i> Li₂C¹⁵N₂.
• Authors of publication: Yan, Xuechao; Ji, Shu-Xiao; Zhang, Shengyuan; Wang, Qianru; Guo, Jianping; Chen, Ping; Xi, Zhenfeng; Wei, Junnian
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2025
• Journal volume: 54
• Journal issue: 15
• Pages of publication: 6246 - 6251
• a: 13.2902 ± 0.0004 Å
• b: 20.7356 ± 0.0006 Å
• c: 22.0373 ± 0.0006 Å
• α: 68.321 ± 0.003°
• β: 85.575 ± 0.002°
• γ: 75.402 ± 0.003°
• Cell volume: 5460.4 ± 0.3 ų
• Cell temperature: 179.99 ± 0.1 K
• Ambient diffraction temperature: 179.99 ± 0.1 K
• Number of distinct elements: 7
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0507
• Residual factor for significantly intense reflections: 0.0339
• Weighted residual factors for significantly intense reflections: 0.0781
• Weighted residual factors for all reflections included in the refinement: 0.0837
• Goodness-of-fit parameter for all reflections included in the refinement: 1.049
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No