Information card for entry 7207312

Structure parameters

• Formula: C34 H24 N6 O2
• Calculated formula: C34 H24 N6 O2
• Title of publication: Improvement of dye-sensitized solar cells' performance through introducing suitable heterocyclic groups to triarylamine dyes.
• Authors of publication: Zhang, Ming-Dao; Pan, Hao; Ju, Xue-Hai; Ji, Ya-Jun; Qin, Ling; Zheng, He-Gen; Zhou, Xing-Fu
• Journal of publication: Physical chemistry chemical physics : PCCP
• Year of publication: 2012
• Journal volume: 14
• Journal issue: 8
• Pages of publication: 2809 - 2815
• a: 14.1772 ± 0.0019 Å
• b: 14.2156 ± 0.0018 Å
• c: 13.9291 ± 0.0019 Å
• α: 90°
• β: 97.092 ± 0.003°
• γ: 90°
• Cell volume: 2785.8 ± 0.6 ų
• Cell temperature: 291 ± 2 K
• Ambient diffraction temperature: 291 ± 2 K
• Number of distinct elements: 4
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/c 1
• Hall space group symbol: -P 2ybc
• Residual factor for all reflections: 0.1213
• Residual factor for significantly intense reflections: 0.0574
• Weighted residual factors for significantly intense reflections: 0.1221
• Weighted residual factors for all reflections included in the refinement: 0.137
• Goodness-of-fit parameter for all reflections included in the refinement: 1.013
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No