Information card for entry 1555771

Structure parameters

• Formula: C49 H53 B3 F6 N6
• Calculated formula: C49 H54 B3 F6 N6
• Title of publication: Orthogonal Bodipy Trimers as Photosensitizers for Photodynamic Action.
• Authors of publication: Ozdemir, Tugba; Bila, Jose Luis; Sozmen, Fazli; Yildirim, Leyla T.; Akkaya, Engin U.
• Journal of publication: Organic letters
• Year of publication: 2016
• Journal volume: 18
• Journal issue: 19
• Pages of publication: 4821 - 4823
• a: 8.651 ± 0.0002 Å
• b: 18.3861 ± 0.0005 Å
• c: 29.434 ± 0.005 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 4681.7 ± 0.8 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 5
• Space group number: 62
• Hermann-Mauguin space group symbol: P b n m
• Hall space group symbol: -P 2c 2ab
• Residual factor for all reflections: 0.086
• Residual factor for significantly intense reflections: 0.0599
• Weighted residual factors for all reflections included in the refinement: 0.2036
• Goodness-of-fit parameter for all reflections included in the refinement: 1.107
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No