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CIF Information Card
Information card for 1100146
1100145 << 1100146 >> 1100147Preview
|
Coordinates |
1100146.cif |
Structure parameters
| Formula | - C9 H12 Cl2 Cu N4 O3 - |
| Calculated formula | - C9 H12 Cl2 Cu N4 O3 - |
| Authors of publication | Esther R. Acuna-Cueva; Rene Faure; Nuria A. Illan-Cabeza; Sonia B. Jimenez-Pulido; Miguel N. Moreno-Carretero; Miguel Quiros |
| Journal of publication | Inorganica Chimica Acta |
| Year of publication | 2003 |
| Journal volume | 351 |
| Pages of publication | 356 - 362 |
| a | 8.8152 ± 0.001 Å |
| b | 10.0526 ± 0.0012 Å |
| c | 15.344 ± 0.002 Å |
| α | 90° |
| β | 91.521 ± 0.009° |
| γ | 90° |
| Cell volume | 1359.3 ± 0.3 Å3 |
| Cell temperature | 293 ± 2 K |
| Ambient diffraction temperature | 293 ± 2 K |
| Number of distinct elements | 6 |
| Hermann-Mauguin symmetry space group | P 1 21/n 1 |
| Hall symmetry space group | -P 2yn |
| Residual factor for all reflections | 0.0504 |
| Residual factor for observed reflections | 0.0411 |
| Weighted residual factors for the observed reflections | 0.1111 |
| Weighted residual factors for all reflections included in the refinement | 0.1178 |
| Goodness-of-fit parameter for observed reflections | 1.072 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |