Information card for entry 8105697
| Formula |
C15 H18 N4 O |
| Calculated formula |
C15 H18 N4 O |
| Title of publication |
Crystal structure of 9-methoxy-2,3,4,4a,5,6-hexahydro-1H-pyrido [1′,2′:1,6]pyrazino[2,3-b]quinoxaline, C15H18N4O |
| Authors of publication |
Zhang, Qiu Yu; Yu, Yu |
| Journal of publication |
Zeitschrift für Kristallographie - New Crystal Structures |
| Year of publication |
2022 |
| Journal volume |
237 |
| Journal issue |
3 |
| Pages of publication |
361 - 363 |
| a |
6.7562 ± 0.0005 Å |
| b |
9.552 ± 0.0006 Å |
| c |
11.4227 ± 0.0008 Å |
| α |
97.206 ± 0.005° |
| β |
102.335 ± 0.006° |
| γ |
108.614 ± 0.007° |
| Cell volume |
667.39 ± 0.09 Å3 |
| Cell temperature |
149.99 ± 0.1 K |
| Ambient diffraction temperature |
149.99 ± 0.1 K |
| Number of distinct elements |
4 |
| Space group number |
2 |
| Hermann-Mauguin space group symbol |
P -1 |
| Hall space group symbol |
-P 1 |
| Residual factor for all reflections |
0.0586 |
| Residual factor for significantly intense reflections |
0.048 |
| Weighted residual factors for significantly intense reflections |
0.1255 |
| Weighted residual factors for all reflections included in the refinement |
0.1388 |
| Goodness-of-fit parameter for all reflections included in the refinement |
1.048 |
| Diffraction radiation probe |
x-ray |
| Diffraction radiation wavelength |
0.71073 Å |
| Diffraction radiation type |
MoKα |
| Has coordinates |
Yes |
| Has disorder |
No |
| Has Fobs |
No |
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https://www.crystallography.net/8105697.html
