Information card for entry 1570249
| Formula |
C15 H12 N2 O3 |
| Calculated formula |
C15 H12 N2 O3 |
| Title of publication |
4-Methyl/Phenyl-1,2,5,6-tetraazafluoranthen-3(2H)-ones Synthesis: Mechanistic Pathway Study and Single-Crystal X-ray Analysis of the Intermediates |
| Authors of publication |
Sarhan, Ahmed A. M.; Haukka, Matti; Barakat, Assem; Soliman, Saied M.; Boraei, Ahmed T. A.; Sopaih, Manar; Salama, Eid E. |
| Journal of publication |
Crystals |
| Year of publication |
2023 |
| Journal volume |
13 |
| Journal issue |
11 |
| Pages of publication |
1537 |
| a |
15.34 ± 0.0004 Å |
| b |
5.0292 ± 0.0001 Å |
| c |
16.7042 ± 0.0004 Å |
| α |
90° |
| β |
100.545 ± 0.002° |
| γ |
90° |
| Cell volume |
1266.93 ± 0.05 Å3 |
| Cell temperature |
120 ± 2 K |
| Ambient diffraction temperature |
120 ± 2 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 |
0.0382 |
| Residual factor for significantly intense reflections |
0.0346 |
| Weighted residual factors for significantly intense reflections |
0.0863 |
| Weighted residual factors for all reflections included in the refinement |
0.089 |
| Goodness-of-fit parameter for all reflections included in the refinement |
1.054 |
| Diffraction radiation wavelength |
1.54184 Å |
| Diffraction radiation type |
CuKα |
| Has coordinates |
Yes |
| Has disorder |
No |
| Has Fobs |
No |
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The link is:
https://www.crystallography.net/1570249.html
