Crystallography Open Database
- COD Home
- Accessing COD Data
- Add Your Data
- Documentation
Information card for entry 7041621
Preview
| Coordinates | 7041621.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C10 H9 Cu N5 O7 |
|---|---|
| Calculated formula | C10 H7 Cu N5 O7 |
| Title of publication | Low temperature heat capacity, standard entropy, standard enthalpy and magnetic property: a new 1D Cu(II) coordination polymer incorporating tetrazole-1-acetic acid and p-nitrobenzoic acid. |
| Authors of publication | Yang, Qi; Ge, Jing; Liu, Xin; Shi, Quan; Ke, Hongshan; Wei, Qing; Xie, Gang; Chen, Sanping; Gao, Shengli |
| Journal of publication | Dalton transactions (Cambridge, England : 2003) |
| Year of publication | 2017 |
| Journal volume | 46 |
| Journal issue | 6 |
| Pages of publication | 1878 - 1884 |
| a | 7.996 ± 0.002 Å |
| b | 8.629 ± 0.002 Å |
| c | 10.973 ± 0.003 Å |
| α | 94.86 ± 0.005° |
| β | 98.907 ± 0.005° |
| γ | 101.907 ± 0.005° |
| Cell volume | 726.5 ± 0.3 Å3 |
| Cell temperature | 296 ± 2 K |
| Ambient diffraction temperature | 296 ± 2 K |
| Number of distinct elements | 5 |
| Space group number | 2 |
| Hermann-Mauguin space group symbol | P -1 |
| Hall space group symbol | -P 1 |
| Residual factor for all reflections | 0.101 |
| Residual factor for significantly intense reflections | 0.0686 |
| Weighted residual factors for significantly intense reflections | 0.1798 |
| Weighted residual factors for all reflections included in the refinement | 0.1991 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.022 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 193799 (current) | 2017-03-05 | cif/ Updating files of 7041621 Original log message: Adding full bibliography for 7041621.cif. |
7041621.cif |
| 189934 | 2017-01-06 | cif/ Adding structures of 7041621 via cif-deposit CGI script. |
7041621.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.