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Information card for entry 2200900
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| Coordinates | 2200900.cif |
|---|---|
| Structure factors | 2200900.hkl |
| Original IUCr paper | HTML |
| Chemical name | 2-Amino-5-(4-chlorophenyl)-1-methylimidazole |
|---|---|
| Formula | C10 H10 Cl N3 |
| Calculated formula | C10 H10 Cl N3 |
| SMILES | Clc1ccc(c2n(c(nc2)N)C)cc1 |
| Title of publication | 2-Amino-5-(4-chlorophenyl)-1-methylimidazole |
| Authors of publication | Rybakov, Victor B.; Babaev, Eugene V.; Belykh, Eugene N. |
| Journal of publication | Acta Crystallographica Section E |
| Year of publication | 2002 |
| Journal volume | 58 |
| Journal issue | 2 |
| Pages of publication | o126 - o128 |
| a | 10.552 ± 0.005 Å |
| b | 12.833 ± 0.005 Å |
| c | 15.432 ± 0.011 Å |
| α | 95.53 ± 0.02° |
| β | 106.57 ± 0.02° |
| γ | 97.02 ± 0.02° |
| Cell volume | 1968.9 ± 1.9 Å3 |
| Cell temperature | 293 ± 2 K |
| Ambient diffraction temperature | 293 ± 2 K |
| Number of distinct elements | 4 |
| Space group number | 2 |
| Hermann-Mauguin space group symbol | P -1 |
| Hall space group symbol | -P 1 |
| Residual factor for significantly intense reflections | 0.0513 |
| Weighted residual factors for all reflections included in the refinement | 0.1333 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.01 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | Yes |
| Revision | Date | Message | Files |
|---|
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