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CIF Information Card
Information card for 7015680
7015679 << 7015680 >> 7015681Preview
|
Coordinates |
7015680.cif |
Structure parameters
| Formula | - C27 H22 Br2 Fe Hg N P - |
| Calculated formula | - C27 H22 Br2 Fe Hg 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 | 16.0531 ± 0.0009 Å |
| b | 8.9781 ± 0.0004 Å |
| c | 19.1 ± 0.0011 Å |
| α | 90° |
| β | 105.934 ± 0.004° |
| γ | 90° |
| Cell volume | 2647 ± 0.2 Å3 |
| Cell temperature | 173 ± 2 K |
| Ambient diffraction temperature | 173 ± 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 | 0.0285 |
| Residual factor for observed reflections | 0.0261 |
| Weighted residual factors for the observed reflections | 0.0723 |
| Weighted residual factors for all reflections included in the refinement | 0.0734 |
| Goodness-of-fit parameter for observed reflections | 1.167 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |