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Information card for entry 4034991
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Coordinates | 4034991.cif |
---|---|
Original paper (by DOI) | HTML |
Common name | DiPhMonoFPhIndenotetracene |
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Chemical name | 9-(4-fluorophenyl)-10-phenylindeno[1,2,3-fg]tetracene |
Formula | C36 H21 F |
Calculated formula | C36 H20.54 F |
Title of publication | Synthesis and Characterization of Electron-Deficient Asymmetrically Substituted Diarylindenotetracenes. |
Authors of publication | Purvis, Lafe J.; Gu, Xingxian; Ghosh, Soumen; Zhang, Zhuoran; Cramer, Christopher J.; Douglas, Christopher J. |
Journal of publication | The Journal of organic chemistry |
Year of publication | 2018 |
Journal volume | 83 |
Journal issue | 4 |
Pages of publication | 1828 - 1841 |
a | 15.9 ± 0.03 Å |
b | 19.904 ± 0.014 Å |
c | 7.73 ± 0.013 Å |
α | 90° |
β | 112.49 ± 0.1° |
γ | 90° |
Cell volume | 2260 ± 6 Å3 |
Cell temperature | 123 ± 2 K |
Ambient diffraction temperature | 123 ± 2 K |
Number of distinct elements | 3 |
Space group number | 15 |
Hermann-Mauguin space group symbol | C 1 2/c 1 |
Hall space group symbol | -C 2yc |
Residual factor for all reflections | 0.0594 |
Residual factor for significantly intense reflections | 0.0479 |
Weighted residual factors for significantly intense reflections | 0.1213 |
Weighted residual factors for all reflections included in the refinement | 0.1301 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.037 |
Diffraction radiation wavelength | 1.54178 Å |
Diffraction radiation type | CuKα |
Has coordinates | Yes |
Has disorder | Yes |
Has Fobs | No |
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