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Information card for entry 8101013
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| Coordinates | 8101013.cif |
|---|
| Formula | C19 H22 N2 O4 S2 |
|---|---|
| Calculated formula | C19 H22 N2 O4 S2 |
| Title of publication | Crystal structure of 1,3-bis(toluene-4-sulfonyl)-2,3,4,7-tetrahydro- 1H-1,3-diazepine, C~19~H~22~N~2~O~4~S~2~ |
| Authors of publication | Wattenbach, Carsten; Frauenrath, Herbert; Palme-König, Rouven; Müller, Ulrich |
| Journal of publication | Zeitschrift für Kristallographie - New Crystal Structures |
| Year of publication | 2001 |
| Journal volume | 216 |
| Journal issue | 3 |
| Pages of publication | 397 - 398 |
| a | 24.6 ± 0.016 Å |
| b | 6.883 ± 0.008 Å |
| c | 11.327 ± 0.003 Å |
| α | 90° |
| β | 91.2 ± 0.04° |
| γ | 90° |
| Cell volume | 1917 ± 3 Å3 |
| Cell temperature | 297 ± 2 K |
| Ambient diffraction temperature | 297 ± 2 K |
| Number of distinct elements | 5 |
| Space group number | 15 |
| Hermann-Mauguin space group symbol | C 1 2/c 1 |
| Hall space group symbol | -C 2yc |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
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