Crystallography Open Database
- COD Home
- Accessing COD Data
- Add Your Data
- Documentation
Information card for entry 7006412
Preview
Coordinates | 7006412.cif |
---|---|
Original paper (by DOI) | HTML |
Chemical name | Bis[2,6-(3-methylpyrazol-1-yl)pyridine]iron(II) diperchlorate acetone solvate |
---|---|
Formula | C29 H32 Cl2 Fe N10 O9 |
Calculated formula | C29 H32 Cl2 Fe N10 O9 |
Title of publication | Structural diversity in iron(II) complexes of 2,6-di(pyrazol-1-yl)pyridine and 2,6-di(3-methylpyrazol-1-yl)pyridine. |
Authors of publication | Elhaïk, Jérôme; Kilner, Colin A.; Halcrow, Malcolm A. |
Journal of publication | Dalton transactions (Cambridge, England : 2003) |
Year of publication | 2006 |
Journal issue | 6 |
Pages of publication | 823 - 830 |
a | 22.8777 ± 0.0002 Å |
b | 11.024 ± 0.0001 Å |
c | 28.3914 ± 0.0003 Å |
α | 90° |
β | 106.332 ± 0.0007° |
γ | 90° |
Cell volume | 6871.49 ± 0.12 Å3 |
Cell temperature | 150 ± 2 K |
Ambient diffraction temperature | 150 ± 2 K |
Number of distinct elements | 6 |
Space group number | 15 |
Hermann-Mauguin space group symbol | C 1 2/c 1 |
Hall space group symbol | -C 2yc |
Residual factor for all reflections | 0.0807 |
Residual factor for significantly intense reflections | 0.0621 |
Weighted residual factors for significantly intense reflections | 0.1745 |
Weighted residual factors for all reflections included in the refinement | 0.1963 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.109 |
Diffraction radiation wavelength | 0.71073 Å |
Diffraction radiation type | MoKα |
Has coordinates | Yes |
Has disorder | Yes |
Has Fobs | No |
For the version history of this entry, please navigate to main COD server.
The link is: https://www.crystallography.net/7006412.html
All data in the COD and the database itself are dedicated to the
public domain and licensed under the
CC0
License
.
Users of the data should acknowledge the original authors of the
structural data.