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CIF Information Card
Information card for 7205975
7205974 << 7205975 >> 7205976Preview
|
Coordinates |
7205975.cif |
Structure parameters
| Formula | - C44 H48 Cl N5 Ni2 O12 - |
| Calculated formula | - C44 H48 Cl N5 Ni2 O12 - |
| Title of publication | Co-crystallization of coordination compounds through second-coordination sphere interactions |
| Authors of publication | Cucos, Andrei; Ursu, Andrei; Madalan, Augustin M.; Duhayon, Carine; Sutter, Jean-Pascal; Andruh, Marius |
| Journal of publication | CrystEngComm |
| Year of publication | 2011 |
| Journal volume | 13 |
| Journal issue | 11 |
| Pages of publication | 3756 |
| a | 13.8843 ± 0.0008 Å |
| b | 23.6202 ± 0.001 Å |
| c | 14.7348 ± 0.0008 Å |
| α | 90° |
| β | 114.441 ± 0.004° |
| γ | 90° |
| Cell volume | 4399.2 ± 0.4 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 | 0.0984 |
| Residual factor for observed reflections | 0.0662 |
| Weighted residual factors for the observed reflections | 0.1716 |
| Weighted residual factors for all reflections included in the refinement | 0.1897 |
| Goodness-of-fit parameter for observed reflections | 1.035 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | Yes |
| Has Fobs | No |