Information card for entry 4508392

Structure parameters

• Formula: C32.5 H30.5 Cd Cl1.5 N2 O2 S4
• Calculated formula: C32.5 H30.5 Cd Cl1.5 N2 O2 S4
• SMILES: [Cd]123([S]=C(S1)OCC)([S]=C(S2)OCC)[n]1c(C)cc(c2ccc4c(cc([n]3c4c12)C)c1ccccc1)c1ccccc1.C(Cl)(Cl)Cl
• Title of publication: Solution-processed hybrid cathode interlayer for inverted organic solar cells.
• Authors of publication: Wu, Yulei; Zhang, Wenjun; Li, Xiaodong; Min, Chao; Jiu, Tonggang; Zhu, Yuejin; Dai, Ning; Fang, Junfeng
• Journal of publication: ACS applied materials & interfaces
• Year of publication: 2013
• Journal volume: 5
• Journal issue: 21
• Pages of publication: 10428 - 10432
• a: 13.049 ± 0.003 Å
• b: 15.994 ± 0.003 Å
• c: 17.871 ± 0.004 Å
• α: 109.06 ± 0.03°
• β: 106.02 ± 0.03°
• γ: 92.22 ± 0.03°
• Cell volume: 3354.1 ± 1.6 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 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: 0.1067
• Residual factor for significantly intense reflections: 0.0724
• Weighted residual factors for significantly intense reflections: 0.1956
• Weighted residual factors for all reflections included in the refinement: 0.2398
• Goodness-of-fit parameter for all reflections included in the refinement: 1.112
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No