Information card for entry 7239466

Structure parameters

• Formula: C15 H7 F5 N2 O
• Calculated formula: C15 H7 F5 N2 O
• Title of publication: Syntheses of mono- and diacylated bipyrroles with rich substitution modes and development of a prodigiosin derivative as a fluorescent Zn(ii) probe
• Authors of publication: Hong, Tao; Song, Heli; Li, Xin; Zhang, Weibing; Xie, Yongshu
• Journal of publication: RSC Advances
• Year of publication: 2014
• Journal volume: 4
• Journal issue: 12
• Pages of publication: 6133
• a: 14.9819 ± 0.0015 Å
• b: 7.9992 ± 0.0007 Å
• c: 11.2134 ± 0.001 Å
• α: 90°
• β: 101.48 ± 0.002°
• γ: 90°
• Cell volume: 1317 ± 0.2 ų
• Cell temperature: 56 ± 2 K
• Ambient diffraction temperature: 56 ± 2 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: 0.0689
• Residual factor for significantly intense reflections: 0.0397
• Weighted residual factors for significantly intense reflections: 0.1125
• Weighted residual factors for all reflections included in the refinement: 0.1446
• Goodness-of-fit parameter for all reflections included in the refinement: 1.072
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No