Information card for entry 7200963

Structure parameters

• Formula: C42 H33 Cl2 N3 O2
• Calculated formula: C42 H33 Cl2 N3 O2
• SMILES: ClCCl.O=C1N(C(=O)C(=C1c1cn(c2ccccc12)Cc1ccccc1)c1cn(c2ccccc12)Cc1ccccc1)Cc1ccccc1
• Title of publication: White light-emitting devices with a single emitting layer based on bisindolylmaleimide fluorophores
• Authors of publication: Lin, Zhenghuan; Wen, Yuh-Sheng; Chow, Tahsin J.
• Journal of publication: Journal of Materials Chemistry
• Year of publication: 2009
• Journal volume: 19
• Journal issue: 29
• Pages of publication: 5141
• a: 20.9958 ± 0.0009 Å
• b: 7.682 ± 0.0003 Å
• c: 22.6056 ± 0.001 Å
• α: 90°
• β: 113.585 ± 0.001°
• γ: 90°
• Cell volume: 3341.5 ± 0.2 ų
• Cell temperature: 150 ± 0.1 K
• Ambient diffraction temperature: 150 ± 0.1 K
• Number of distinct elements: 5
• 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: 0.1066
• Residual factor for significantly intense reflections: 0.0516
• Weighted residual factors for significantly intense reflections: 0.0944
• Weighted residual factors for all reflections included in the refinement: 0.1153
• Goodness-of-fit parameter for all reflections included in the refinement: 1.039
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No