Crystallography Open Database
- COD Home
- Accessing COD Data
- Add Your Data
- Documentation
Information card for entry 2203394
Preview
Coordinates | 2203394.cif |
---|---|
Original IUCr paper | HTML |
Chemical name | Aquabis(tetrahydrofuran)hexakis(trifluoroacetato)oxozinc(II)diiron(III) |
---|---|
Formula | C20 H18 F18 Fe2 O16 Zn |
Calculated formula | C20 H18 F18 Fe2.001 O16 Zn0.999 |
Title of publication | Aquabis(tetrahydrofuran)hexakis(trifluoroacetato)(μ~3~-oxo)zinc(II)diiron(III) |
Authors of publication | Amini, Mostafa M.; Yadavi, Marzieh; Ng, Seik Weng |
Journal of publication | Acta Crystallographica Section E |
Year of publication | 2004 |
Journal volume | 60 |
Journal issue | 4 |
Pages of publication | m495 - m497 |
a | 9.22 ± 0.0006 Å |
b | 12.8671 ± 0.0009 Å |
c | 16.448 ± 0.001 Å |
α | 96.233 ± 0.001° |
β | 105.756 ± 0.001° |
γ | 99.401 ± 0.001° |
Cell volume | 1828.6 ± 0.2 Å3 |
Cell temperature | 163 ± 2 K |
Ambient diffraction temperature | 163 ± 2 K |
Number of distinct elements | 6 |
Space group number | 2 |
Hermann-Mauguin space group symbol | P -1 |
Hall space group symbol | -P 1 |
Residual factor for all reflections | 0.057 |
Residual factor for significantly intense reflections | 0.042 |
Weighted residual factors for significantly intense reflections | 0.108 |
Weighted residual factors for all reflections included in the refinement | 0.119 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.031 |
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/2203394.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.