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Information card for entry 2010572
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| Coordinates | 2010572.cif |
|---|---|
| Structure factors | 2010572.hkl |
| Original IUCr paper | HTML |
| Chemical name | (1R,2R)-N,N-bis(8-quinoline sulfonylamino)-1,2-diphenylethylenediamine acetone (1\1) |
|---|---|
| Formula | C35 H32 N4 O5 S2 |
| Calculated formula | C35 H26.006 N4 O5 S2 |
| SMILES | O=S(=O)(c1cccc2c1nccc2)N[C@@H]([C@@H](c1ccccc1)NS(=O)(=O)c1cccc2c1nccc2)c1ccccc1.CC(=O)C |
| Title of publication | (1<i>R</i>,2<i>R</i>)-1,2-Diphenyl-1,2-bis(8-quinolinesulfonylamino)ethylenediamine‒acetone (1/1) |
| Authors of publication | Dong, Chune; Zhang, Junlong; Zhang, Liangfu; Yu, Zuolong |
| Journal of publication | Acta Crystallographica Section C |
| Year of publication | 2000 |
| Journal volume | 56 |
| Journal issue | 1 |
| Pages of publication | e21 - e21 |
| a | 9.717 ± 0.002 Å |
| b | 9.495 ± 0.001 Å |
| c | 17.542 ± 0.003 Å |
| α | 90° |
| β | 97.13 ± 0.01° |
| γ | 90° |
| Cell volume | 1606 ± 0.5 Å3 |
| Cell temperature | 296 ± 2 K |
| Ambient diffraction temperature | 296 ± 2 K |
| Number of distinct elements | 5 |
| Space group number | 4 |
| Hermann-Mauguin space group symbol | P 1 21 1 |
| Hall space group symbol | P 2yb |
| Residual factor for all reflections | 0.0415 |
| Residual factor for significantly intense reflections | 0.0319 |
| Weighted residual factors for all reflections included in the refinement | 0.0742 |
| Goodness-of-fit parameter for all reflections included in the refinement | 0.944 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | Yes |
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