Information card for entry 4518555

Structure parameters

• Formula: C112 H98 Au Cl9 N2 O13 P6 Pt2
• Calculated formula: C112 H98 Au Cl9.0001 N2 O13 P6 Pt2
• Title of publication: Elaborate Design of d⁸-d¹⁰ Heteronuclear Phosphors for Ultrahigh-Efficiency Solution-Processed Organic Light-Emitting Diodes.
• Authors of publication: Wang, Zhao-Yi; Zhang, Li-Yi; Xu, Liang-Jin; Shi, Lin-Xi; Wang, Jin-Yun; Chen, Zhong-Ning
• Journal of publication: ACS applied materials & interfaces
• Year of publication: 2021
• Journal volume: 13
• Journal issue: 12
• Pages of publication: 14433 - 14439
• a: 13.2884 ± 0.001 Å
• b: 16.9733 ± 0.0017 Å
• c: 25.489 ± 0.002 Å
• α: 97.061 ± 0.003°
• β: 99.631 ± 0.003°
• γ: 95.252 ± 0.003°
• Cell volume: 5587.9 ± 0.8 ų
• Cell temperature: 100.02 K
• Ambient diffraction temperature: 100.02 K
• Number of distinct elements: 8
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0716
• Residual factor for significantly intense reflections: 0.0621
• Weighted residual factors for significantly intense reflections: 0.1645
• Weighted residual factors for all reflections included in the refinement: 0.1715
• Goodness-of-fit parameter for all reflections included in the refinement: 1.031
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No