Information card for entry 1502782

Structure parameters

• Formula: C29 H17 B F2 I2 N2
• Calculated formula: C29 H17 B F2 I2 N2
• Title of publication: Aromatic Ring-Fused BODIPY-Based Conjugated Polymers Exhibiting Narrow Near-Infrared Emission Bands
• Authors of publication: Nagai, Atsushi; Chujo, Yoshiki
• Journal of publication: Macromolecules
• Year of publication: 2010
• Journal volume: 43
• Journal issue: 1
• Pages of publication: 193
• a: 7.4515 ± 0.0007 Å
• b: 11.6557 ± 0.0014 Å
• c: 15.1935 ± 0.0015 Å
• α: 110.611 ± 0.003°
• β: 93.971 ± 0.003°
• γ: 92.562 ± 0.004°
• Cell volume: 1228.8 ± 0.2 ų
• Cell temperature: 93 ± 2 K
• Ambient diffraction temperature: 93 ± 2 K
• Number of distinct elements: 6
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0817
• Residual factor for significantly intense reflections: 0.0586
• Weighted residual factors for significantly intense reflections: 0.1523
• Weighted residual factors for all reflections included in the refinement: 0.1729
• Goodness-of-fit parameter for all reflections included in the refinement: 1.134
• Diffraction radiation wavelength: 0.71075 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No