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Information card for entry 2200803
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| Coordinates | 2200803.cif |
|---|---|
| Original IUCr paper | HTML |
| Common name | Pigment Orange 2 |
|---|---|
| Chemical name | 1-[(2-nitrophenyl)hydrazono]-1H-naphthalen-2-one |
| Formula | C16 H11 N3 O3 |
| Calculated formula | C16 H11 N3 O3 |
| SMILES | O=C1C(=NNc2c(N(=O)=O)cccc2)c2ccccc2C=C1 |
| Title of publication | 1-[(2-Nitrophenyl)hydrazono]-1<i>H</i>-naphthalen-2-one (Pigment Orange 2) from powder data |
| Authors of publication | Yatsenko, Alexandr V.; Paseshnichenko, Ksenia A.; Chernyshev, Vladimir V.; Schenk, Henk |
| Journal of publication | Acta Crystallographica Section E |
| Year of publication | 2001 |
| Journal volume | 57 |
| Journal issue | 12 |
| Pages of publication | o1152 - o1153 |
| a | 15.036 ± 0.005 Å |
| b | 12.722 ± 0.004 Å |
| c | 7.042 ± 0.003 Å |
| α | 90° |
| β | 90° |
| γ | 90° |
| Cell volume | 1347.1 ± 0.8 Å3 |
| Cell temperature | 295 ± 2 K |
| Ambient diffraction temperature | 295 ± 2 K |
| Number of distinct elements | 4 |
| Space group number | 19 |
| Hermann-Mauguin space group symbol | P 21 21 21 |
| Hall space group symbol | P 2ac 2ab |
| Goodness-of-fit parameter for all reflections | 3.86 |
| Diffraction radiation wavelength | 1.5418 Å |
| Diffraction radiation type | CuKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
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