Information card for entry 2001829
| Chemical name |
rac-1-methyl-3-nitro-{(1R,6S,8S)-6-phenyl-5,8-(tetramethylene)tricyclo [3.2.1.0^2.7^]oct-3-eno}[4,3-b]pyrrole |
| Formula |
C21 H22 N2 O2 |
| Calculated formula |
C21 H22 N2 O2 |
| Title of publication |
Structure of a tricyclo[3.2.1.0^2,7^]octene derivative: a double bridged central ring in an octahydrobenz[<i>g</i>]-3-nitroindole |
| Authors of publication |
Meetsma, A.; ten Have, R.; Leusink, F. R.; van Leusen, A. M. |
| Journal of publication |
Acta Crystallographica Section C |
| Year of publication |
1993 |
| Journal volume |
49 |
| Journal issue |
4 |
| Pages of publication |
826 - 828 |
| a |
7.799 ± 0.001 Å |
| b |
9.872 ± 0.001 Å |
| c |
11.77 ± 0.001 Å |
| α |
109.638 ± 0.004° |
| β |
100.339 ± 0.006° |
| γ |
97.756 ± 0.006° |
| Cell volume |
820.77 ± 0.16 Å3 |
| Cell temperature |
130 K |
| Ambient diffraction temperature |
130 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 |
0.051 |
| Residual factor for significantly intense reflections |
0.048 |
| Weighted residual factors for all reflections |
0.059 |
| Weighted residual factors for significantly intense reflections |
0.058 |
| Goodness-of-fit parameter for all reflections |
0.725 |
| Goodness-of-fit parameter for significantly intense reflections |
0.751 |
| Diffraction radiation wavelength |
0.71073 Å |
| Diffraction radiation type |
MoKα |
| Has coordinates |
Yes |
| Has disorder |
No |
| Has Fobs |
No |
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The link is:
https://www.crystallography.net/2001829.html
