Information card for entry 2002097
| Formula |
C15 H17 Cl N2 O |
| Calculated formula |
C15 H17 Cl N2 O |
| Title of publication |
2,4-Dimethyl-(1<i>H</i>)-naphtho[2,3-<i>b</i>][1,5]diazepinium chloride monohydrate |
| Authors of publication |
Rodier, N.; Agafonov, V.; Dubois, P.; Mariaud, M.; Levillain, P.; Cense, J. M. |
| Journal of publication |
Acta Crystallographica Section C |
| Year of publication |
1993 |
| Journal volume |
49 |
| Journal issue |
1 |
| Pages of publication |
156 - 159 |
| a |
10.276 ± 0.001 Å |
| b |
7.091 ± 0.001 Å |
| c |
11.38 ± 0.0009 Å |
| α |
98.79 ± 0.01° |
| β |
105.26 ± 0.01° |
| γ |
115.23 ± 0.01° |
| Cell volume |
689.5 ± 0.17 Å3 |
| Cell temperature |
294 K |
| Number of distinct elements |
5 |
| Space group number |
2 |
| Hermann-Mauguin space group symbol |
P -1 |
| Hall space group symbol |
-P 1 |
| Residual factor for significantly intense reflections |
0.041 |
| Weighted residual factors for significantly intense reflections |
0.052 |
| Goodness-of-fit parameter for significantly intense reflections |
1.75 |
| Diffraction radiation wavelength |
1.5418 Å |
| Diffraction radiation type |
CuKα |
| Has coordinates |
Yes |
| Has disorder |
No |
| Has Fobs |
No |
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https://www.crystallography.net/2002097.html
