Information card for entry 4516604

Structure parameters

• Formula: C62 H58 N8 O4 Si
• Calculated formula: C62 H58 N8 O4 Si
• Title of publication: Solution-Processable Silicon Phthalocyanines in Electroluminescent and Photovoltaic Devices.
• Authors of publication: Zysman-Colman, Eli; Ghosh, Sanjay S.; Xie, Guohua; Varghese, Shinto; Chowdhury, Mithun; Sharma, Nidhi; Cordes, David B.; Slawin, Alexandra M. Z.; Samuel, Ifor D. W.
• Journal of publication: ACS applied materials & interfaces
• Year of publication: 2016
• Journal volume: 8
• Journal issue: 14
• Pages of publication: 9247 - 9253
• a: 11.313 ± 0.002 Å
• b: 12.132 ± 0.002 Å
• c: 19.504 ± 0.004 Å
• α: 90.596 ± 0.003°
• β: 103.058 ± 0.005°
• γ: 90.793 ± 0.004°
• Cell volume: 2607.2 ± 0.8 ų
• Cell temperature: 93 K
• Ambient diffraction temperature: 93 K
• Number of distinct elements: 5
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0631
• Residual factor for significantly intense reflections: 0.0529
• Weighted residual factors for significantly intense reflections: 0.1425
• Weighted residual factors for all reflections included in the refinement: 0.1462
• Goodness-of-fit parameter for all reflections included in the refinement: 1.049
• Diffraction radiation wavelength: 0.71075 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No