Information card for entry 7135170

Structure parameters

• Formula: C19 H13 N O2
• Calculated formula: C19 H13 N O2
• Title of publication: Manipulating RTP properties of the same organic molecule by polymorphic engineering.
• Authors of publication: Wang, Deliang; Wu, Hongzhuo; Lin, Songwang; Wang, Kangfan; Wang, Dong; Xiong, Yu; Tang, Ben Zhong
• Journal of publication: Chemical communications (Cambridge, England)
• Year of publication: 2025
• a: 27.591 ± 0.001 Å
• b: 8.5988 ± 0.0004 Å
• c: 12.4 ± 0.0005 Å
• α: 90°
• β: 100.846 ± 0.004°
• γ: 90°
• Cell volume: 2889.3 ± 0.2 ų
• Cell temperature: 100.01 ± 0.1 K
• Ambient diffraction temperature: 100.01 ± 0.1 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: 0.0567
• Residual factor for significantly intense reflections: 0.0464
• Weighted residual factors for significantly intense reflections: 0.1234
• Weighted residual factors for all reflections included in the refinement: 0.1333
• Goodness-of-fit parameter for all reflections included in the refinement: 1.012
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 1.54184 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No