Crystallography Open Database
| COD Home |
|---|
| Accessing COD Data |
|---|
| Add Your Data |
|---|
| Documentation |
|---|
CIF Information Card
Information card for 7205976
7205975 << 7205976 >> 7205977Preview
|
Coordinates |
7205976.cif |
Structure parameters
| Formula | - C46 H62 Cr N11 Ni2 O10 S4 - |
| Calculated formula | - C46 H54 Cr N11 Ni2 O10 S4 - |
| 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 | 10.9775 ± 0.0009 Å |
| b | 12.3684 ± 0.0009 Å |
| c | 12.8226 ± 0.001 Å |
| α | 63.924 ± 0.005° |
| β | 69.868 ± 0.006° |
| γ | 79.319 ± 0.006° |
| Cell volume | 1467 ± 0.2 Å3 |
| Cell temperature | 293 ± 2 K |
| Ambient diffraction temperature | 293 ± 2 K |
| Number of distinct elements | 7 |
| Hermann-Mauguin symmetry space group | P -1 |
| Hall symmetry space group | -P 1 |
| Residual factor for all reflections | 0.0813 |
| Residual factor for observed reflections | 0.0484 |
| Weighted residual factors for the observed reflections | 0.1062 |
| Weighted residual factors for all reflections included in the refinement | 0.1153 |
| Goodness-of-fit parameter for observed reflections | 0.924 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |