Crystallography Open Database
| COD Home |
|---|
| Accessing COD Data |
|---|
| Add Your Data |
|---|
| Documentation |
|---|
CIF Information Card
Information card for 7015665
7015664 << 7015665 >> 7015666Preview
|
Coordinates |
7015665.cif |
Structure parameters
| Formula | - C27 H22 Br2 Cd Fe N P - |
| Calculated formula | - C27 H22 Br2 Cd Fe N P - |
| Title of publication | The coordination behaviour of ferrocene-based pyridylphosphine ligands towards Zn(II), Cd(II) and Hg(II). |
| Authors of publication | Siemeling, Ulrich; Klemann, Thorsten; Bruhn, Clemens; Schulz, Jiří; Štěpnička, Petr |
| Journal of publication | Dalton transactions (Cambridge, England : 2003) |
| Year of publication | 2011 |
| Journal volume | 40 |
| Journal issue | 17 |
| Pages of publication | 4722 - 4740 |
| a | 14.8184 ± 0.0013 Å |
| b | 9.3495 ± 0.0006 Å |
| c | 18.8737 ± 0.0017 Å |
| α | 90° |
| β | 91.972 ± 0.007° |
| γ | 90° |
| Cell volume | 2613.3 ± 0.4 Å3 |
| Cell temperature | 203 ± 2 K |
| Ambient diffraction temperature | 203 ± 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 | 0.0549 |
| Residual factor for observed reflections | 0.031 |
| Weighted residual factors for the observed reflections | 0.0605 |
| Weighted residual factors for all reflections included in the refinement | 0.0638 |
| Goodness-of-fit parameter for observed reflections | 0.766 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |