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Information card for entry 2021432
Preview
| Coordinates | 2021432.cif |
|---|---|
| Structure factors | 2021432.hkl |
| Original IUCr paper | HTML |
| Chemical name | 3-((<i>E</i>)-{(<i>E</i>)-[1-(Biphenyl-4-yl)ethylidene]hydrazinylidene}methyl)-1-methyl-1<i>H</i>-indole acetonitrile monosolvate |
|---|---|
| Formula | C26 H24 N4 |
| Calculated formula | C26 H24 N4 |
| SMILES | c1ccccc1c1ccc(cc1)/C(C)=N/N=C/c1c2ccccc2n(c1)C.CC#N |
| Title of publication | Synthesis, structure and antiproliferative and optical activities of two new biphenyl-derived Schiff bases |
| Authors of publication | Tan, Xue-Jie; Zhang, Ling-Yao; Sun, Yuan-Kai; Zhou, Xue-Min |
| Journal of publication | Acta Crystallographica Section C |
| Year of publication | 2019 |
| Journal volume | 75 |
| Journal issue | 2 |
| a | 8.128 ± 0.0002 Å |
| b | 8.2147 ± 0.0001 Å |
| c | 32.9809 ± 0.0006 Å |
| α | 90° |
| β | 90.252 ± 0.002° |
| γ | 90° |
| Cell volume | 2202.08 ± 0.07 Å3 |
| Cell temperature | 298 ± 2 K |
| Ambient diffraction temperature | 298 ± 2 K |
| Number of distinct elements | 3 |
| Space group number | 14 |
| Hermann-Mauguin space group symbol | P 1 21/c 1 |
| Hall space group symbol | -P 2ybc |
| Residual factor for all reflections | 0.0607 |
| Residual factor for significantly intense reflections | 0.0525 |
| Weighted residual factors for significantly intense reflections | 0.1403 |
| Weighted residual factors for all reflections included in the refinement | 0.1505 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.024 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | Yes |
| Revision | Date | Message | Files |
|---|---|---|---|
| 213096 (current) | 2019-01-16 | cif/ hkl/ Adding structures of 2021432 via cif-deposit CGI script. |
2021432.cif 2021432.hkl |
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Users of the data should acknowledge the original authors of the
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