Crystallography Open Database
- COD Home
- Accessing COD Data
- Add Your Data
- Documentation
Information card for entry 7056255
Preview
Coordinates | 7056255.cif |
---|---|
Original paper (by DOI) | HTML |
Formula | C13 H22 Cd N4 O8 |
---|---|
Calculated formula | C13 H22 Cd N4 O8 |
Title of publication | Synthesis and structural diversity of d10 metal coordination polymers constructed from new semi-rigid bis(3-methyl-1H-pyrazole-4-carboxylic acid)alkane ligands |
Authors of publication | Cheng, Meiling; Wang, Qinghua; Bao, Jinting; Wu, Yujuan; Sun, Lin; Yang, Bingxin; Liu, Qi |
Journal of publication | New J. Chem. |
Year of publication | 2017 |
a | 12.8322 ± 0.0012 Å |
b | 10.9479 ± 0.001 Å |
c | 12.991 ± 0.0012 Å |
α | 90° |
β | 98.115 ± 0.002° |
γ | 90° |
Cell volume | 1806.8 ± 0.3 Å3 |
Cell temperature | 296 ± 2 K |
Ambient diffraction temperature | 296 ± 2 K |
Number of distinct elements | 5 |
Space group number | 14 |
Hermann-Mauguin space group symbol | P 1 21/c 1 |
Hall space group symbol | -P 2ybc |
Residual factor for all reflections | 0.0223 |
Residual factor for significantly intense reflections | 0.0201 |
Weighted residual factors for significantly intense reflections | 0.0528 |
Weighted residual factors for all reflections included in the refinement | 0.054 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.04 |
Diffraction radiation wavelength | 0.71073 Å |
Diffraction radiation type | MoKα |
Has coordinates | Yes |
Has disorder | No |
Has Fobs | No |
Revision | Date | Message | Files |
---|---|---|---|
197061 (current) | 2017-05-31 | cif/ Adding structures of 7056255, 7056256, 7056257, 7056258, 7056259, 7056260, 7056261, 7056262 via cif-deposit CGI script. |
7056255.cif |
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.