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CIF Information Card
Information card for 2014389
2014388 << 2014389 >> 2014390Preview
|
Coordinates |
2014389.cif |
|
Structure factors |
2014389.hkl |
Structure parameters
| Formula | - C19 H16 Cl N5 O2 - |
| Calculated formula | - C19 H16 Cl N5 O2 - |
| Title of publication | 5-Chloro-3-methyl-4-[3-(4-nitrophenyl)-4,5-dihydro-1<i>H</i>-pyrazol-5-yl]-1-phenyl-1<i>H</i>-pyrazole: a chain of fused hydrogen-bonded rings |
| Authors of publication | Insuasty, Braulio; Torres, Harlen; Cobo, Justo; Low, John N.; Glidewell, Christopher |
| Journal of publication | Acta Crystallographica, Section C |
| Year of publication | 2006 |
| Journal volume | 62 |
| Pages of publication | o30 - o32 |
| a | 5.5055 ± 0.0002 Å |
| b | 11.8317 ± 0.0003 Å |
| c | 13.5668 ± 0.0004 Å |
| α | 83.321 ± 0.0017° |
| β | 78.956 ± 0.0017° |
| γ | 86.396 ± 0.0018° |
| Cell volume | 860.73 ± 0.05 Å3 |
| Cell temperature | 120 ± 2 K |
| Ambient diffraction temperature | 120 ± 2 K |
| Number of distinct elements | 5 |
| Hermann-Mauguin symmetry space group | P -1 |
| Hall symmetry space group | -P 1 |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | Yes |