Crystallography Open Database
- COD Home
- Accessing COD Data
- Add Your Data
- Documentation
Information card for entry 2019693
Preview
Coordinates | 2019693.cif |
---|---|
Structure factors | 2019693.hkl |
Original IUCr paper | HTML |
Chemical name | Poly[[(μ-pentafluorobenzoato-κ^2^<i>O</i>:<i>O</i>')(pentafluorobenzoato-κ<i>O</i>)(μ-pyrazine-κ^2^<i>N</i>:<i>N</i>'</i>)copper(II)]: |
---|---|
Formula | C18 H4 Cu F10 N2 O4 |
Calculated formula | C18 H4 Cu F10 N2 O4 |
Title of publication | Poly[(μ-pentafluorobenzoato-κ^2^<i>O</i>:<i>O</i>')(pentafluorobenzoato-κ<i>O</i>)(μ-pyrazine-κ^2^<i>N</i>:<i>N</i>')copper(II)]: a coordination polymer linked into a three-dimensional network by intermolecular C—H···F—C interactions |
Authors of publication | Han, Li-Juan; Kong, Ya-Jie |
Journal of publication | Acta Crystallographica Section C |
Year of publication | 2014 |
Journal volume | 70 |
Journal issue | 11 |
Pages of publication | 1017 - 1020 |
a | 4.81 ± 0.0012 Å |
b | 13.095 ± 0.003 Å |
c | 15.366 ± 0.004 Å |
α | 89.784 ± 0.003° |
β | 89.654 ± 0.003° |
γ | 86.678 ± 0.003° |
Cell volume | 966.2 ± 0.4 Å3 |
Cell temperature | 293 ± 2 K |
Ambient diffraction temperature | 293 ± 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 | 0.0413 |
Residual factor for significantly intense reflections | 0.0369 |
Weighted residual factors for significantly intense reflections | 0.098 |
Weighted residual factors for all reflections included in the refinement | 0.1015 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.035 |
Diffraction radiation wavelength | 0.71073 Å |
Diffraction radiation type | MoKα |
Has coordinates | Yes |
Has disorder | No |
Has Fobs | Yes |
For the version history of this entry, please navigate to main COD server.
The link is: https://www.crystallography.net/2019693.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.