Crystallography Open Database
| COD Home |
|---|
| Accessing COD Data |
|---|
| Add Your Data |
|---|
| Documentation |
|---|
CIF Information Card
Information card for 7015590
7015589 << 7015590 >> 7015591Preview
|
Coordinates |
7015590.cif |
Structure parameters
| Formula | - C12 H12 Cl4 N18 Zn5 - |
| Calculated formula | - C12 H12 Cl4 N18 Zn5 - |
| Title of publication | Photophysical properties of Kuratowski-type coordination compounds [M(II)Zn(4)Cl(4)(Me(2)bta)(6)] (M(II) = Zn or Ru) featuring long-lived excited electronic states. |
| Authors of publication | Liu, Ying-Ya; Grzywa, Maciej; Tonigold, Markus; Sastre, German; Schüttrigkeit, Tanja; Leeson, Nicholas S.; Volkmer, Dirk |
| Journal of publication | Dalton transactions (Cambridge, England : 2003) |
| Year of publication | 2011 |
| Journal volume | 40 |
| Journal issue | 22 |
| Pages of publication | 5926 - 5938 |
| a | 14.937 ± 0.003 Å |
| b | 14.937 ± 0.003 Å |
| c | 12.059 ± 0.003 Å |
| α | 90° |
| β | 90° |
| γ | 90° |
| Cell volume | 2690.5 ± 1 Å3 |
| Cell temperature | 220 ± 2 K |
| Ambient diffraction temperature | 220 ± 2 K |
| Number of distinct elements | 5 |
| Hermann-Mauguin symmetry space group | I 41/a :2 |
| Hall symmetry space group | -I 4ad |
| Residual factor for all reflections | 0.0291 |
| Residual factor for observed reflections | 0.0225 |
| Weighted residual factors for the observed reflections | 0.0477 |
| Weighted residual factors for all reflections included in the refinement | 0.0495 |
| Goodness-of-fit parameter for observed reflections | 1.048 |
| Diffraction radiation probe | x-ray |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | mokα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |