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CIF Information Card
Information card for 7205891
7205890 << 7205891 >> 7205892Preview
|
Coordinates |
7205891.cif |
Structure parameters
| Formula | - C20 H18 Hg2 I4 N6 O2 S2 - |
| Calculated formula | - C20 H18 Hg2 I4 N6 O2 S2 - |
| Title of publication | C‒H⋯π synthon repetitivity in coordination compounds, established from single-crystal and powder diffraction |
| Authors of publication | Khavasi, Hamid Reza; Salimi, Ali Reza; Eshtiagh-Hosseini, Hossein; Amini, Mostafa M. |
| Journal of publication | CrystEngComm |
| Year of publication | 2011 |
| Journal volume | 13 |
| Journal issue | 11 |
| Pages of publication | 3710 |
| a | 17.4171 ± 0.0018 Å |
| b | 10.4197 ± 0.0011 Å |
| c | 8.7144 ± 0.0009 Å |
| α | 90° |
| β | 92.169 ± 0.008° |
| γ | 90° |
| Cell volume | 1580.4 ± 0.3 Å3 |
| Cell temperature | 298 ± 2 K |
| Ambient diffraction temperature | 298 ± 2 K |
| Number of distinct elements | 7 |
| Hermann-Mauguin symmetry space group | P 1 21/c 1 |
| Hall symmetry space group | -P 2ybc |
| Residual factor for all reflections | 0.1153 |
| Residual factor for observed reflections | 0.0681 |
| Weighted residual factors for the observed reflections | 0.1417 |
| Weighted residual factors for all reflections included in the refinement | 0.1616 |
| Goodness-of-fit parameter for observed reflections | 1.106 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |