Information card for entry 2001800
| Formula |
C17 H17 Br N2 |
| Calculated formula |
C17 H17 Br N2 |
| SMILES |
Brc1ccc(cc1)C1N2CCCCN1c1c2cccc1 |
| Title of publication |
Structure of 11-(4-bromophenyl)-1,2,3,4,5,6-hexahydro-1,6-methano-1,6-benzodiazocine |
| Authors of publication |
Dunaj-Jurčo, M.; Mikloš, D.; Jendrichovský, J. |
| Journal of publication |
Acta Crystallographica Section C |
| Year of publication |
1993 |
| Journal volume |
49 |
| Journal issue |
4 |
| Pages of publication |
765 - 766 |
| a |
6.981 ± 0.007 Å |
| b |
11.443 ± 0.009 Å |
| c |
9.255 ± 0.011 Å |
| α |
76.15 ± 0.08° |
| β |
85.75 ± 0.09° |
| γ |
74.13 ± 0.07° |
| Cell volume |
690.4 ± 1.2 Å3 |
| Number of distinct elements |
4 |
| Space group number |
2 |
| Hermann-Mauguin space group symbol |
P -1 |
| Hall space group symbol |
-P 1 |
| Diffraction radiation wavelength |
0.71073 Å |
| Diffraction radiation type |
Mo |
| Has coordinates |
Yes |
| Has disorder |
No |
| Has Fobs |
No |
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https://www.crystallography.net/2001800.html
