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CIF Information Card
Information card for 1100705
1100704 << 1100705 >> 1100706Preview
|
Coordinates |
1100705.cif |
Structure parameters
| Formula | - C18 H18 Cu2 I2 N4 S2 - |
| Calculated formula | - C18 H18 Cu2 I2 N4 S2 - |
| a | 10.033 ± 0.001 Å |
| b | 8.7293 ± 0.0008 Å |
| c | 12.3735 ± 0.0011 Å |
| α | 90° |
| β | 91.421 ± 0.001° |
| γ | 90° |
| Cell volume | 1083.35 ± 0.18 Å3 |
| Cell temperature | 158 ± 2 K |
| Ambient diffraction temperature | 158 ± 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 | 0.0313 |
| Residual factor for observed reflections | 0.029 |
| Weighted residual factors for the observed reflections | 0.0709 |
| Weighted residual factors for all reflections included in the refinement | 0.0729 |
| Goodness-of-fit parameter for observed reflections | 1.073 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |