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Information card for entry 8107632
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| Coordinates | 8107632.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Common name | 1-[2-[(2-chloro-3-thienyl)methoxy]-2-(2,4-dichloro-phenyl)ethyl]-1H-imidazole |
|---|---|
| Formula | C16 H13 Cl3 N2 O S |
| Calculated formula | C16 H13 Cl3 N2 O S |
| SMILES | Clc1sccc1COC(c1ccc(Cl)cc1Cl)Cn1ccnc1 |
| Title of publication | Crystal structure of 1-[2-[(2-chloro-3-thienyl)methoxy]-2-(2,4-dichlorophenyl) ethyl]-1H-imidazole, C16H13Cl3N2OS |
| Authors of publication | Pansuriya, Pramod B.; Friedrich, Holger B.; Maguire, Glenn E. M. |
| Journal of publication | Zeitschrift für Kristallographie - New Crystal Structures |
| Year of publication | 2015 |
| Journal volume | 230 |
| Journal issue | 1 |
| Pages of publication | 5 - 6 |
| a | 10.0547 ± 0.0004 Å |
| b | 9.8289 ± 0.0003 Å |
| c | 16.6993 ± 0.0007 Å |
| α | 90° |
| β | 90.659 ± 0.002° |
| γ | 90° |
| Cell volume | 1650.23 ± 0.11 Å3 |
| Ambient diffraction temperature | 173 K |
| Number of distinct elements | 6 |
| Space group number | 14 |
| Hermann-Mauguin space group symbol | P 1 21/c 1 |
| Hall space group symbol | -P 2ybc |
| Residual factor for significantly intense reflections | 0.0386 |
| Weighted residual factors for significantly intense reflections | 0.0891 |
| Diffraction radiation probe | x-ray |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 287110 (current) | 2023-10-25 | cif/ Adding structures of 8107632 via cif-deposit CGI script. |
8107632.cif |
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