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CIF Information Card
Information card for 2015247
2015246 << 2015247 >> 2015248Preview
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Coordinates |
2015247.cif |
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Structure factors |
2015247.hkl |
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Original IUCr paper |
HTML |
Structure parameters
| Chemical name | 4-[(4-chloro-3-nitrobenzoyl)hydrazinocarbonyl]pyridinium chloride |
| Formula | - C13 H10 Cl2 N4 O4 - |
| Calculated formula | - C13 H10 Cl2 N4 O4 - |
| Title of publication | Hydrogen-bonded framework structures in 4-[(4-chloro-3-nitrobenzoyl)hydrazinocarbonyl]pyridinium chloride and <i>N</i>-3,5-dinitrobenzoyl-N'-isonicotinoylhydrazine |
| Authors of publication | Vasconcelos, Thatyana R. A.; de Souza, Marcus V. N.; Wardell, Solange M. S. V.; Wardell, James L.; Low, John N.; Glidewell, Christopher |
| Journal of publication | Acta Crystallographica, Section C |
| Year of publication | 2006 |
| Journal volume | 62 |
| Journal issue | 4 |
| Pages of publication | o222 - o226 |
| a | 15.2414 ± 0.0002 Å |
| b | 22.643 ± 0.0009 Å |
| c | 8.3783 ± 0.0005 Å |
| α | 90° |
| β | 90° |
| γ | 90° |
| Cell volume | 2891.4 ± 0.2 Å3 |
| Cell temperature | 120 ± 2 K |
| Ambient diffraction temperature | 120 ± 2 K |
| Number of distinct elements | 5 |
| Hermann-Mauguin symmetry space group | A b a 2 |
| Hall symmetry space group | A 2 -2ac |
| Residual factor for all reflections | 0.0331 |
| Residual factor for observed reflections | 0.0299 |
| Weighted residual factors for the observed reflections | 0.0718 |
| Weighted residual factors for all reflections included in the refinement | 0.0741 |
| Goodness-of-fit parameter for observed reflections | 1.05 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | Yes |