Crystallography Open Database
- COD Home
- Accessing COD Data
- Add Your Data
- Documentation
Information card for entry 7240334
Preview
| Coordinates | 7240334.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C28 H21 Cl2 N5 O5 Zn |
|---|---|
| Calculated formula | C28 H21 Cl2 N5 O5 Zn |
| Title of publication | The impact of positional isomerism on electronic and photochromic properties of 1-D zinc-based naphthalene diimide coordination polymers |
| Authors of publication | Hao, Pengfei; Zhu, Huihui; Pang, Yue; Shen, Junju; Fu, Yunlong |
| Journal of publication | CrystEngComm |
| Year of publication | 2020 |
| a | 7.574 ± 0.0008 Å |
| b | 12.2366 ± 0.0012 Å |
| c | 15.0059 ± 0.0015 Å |
| α | 90° |
| β | 93.741 ± 0.003° |
| γ | 90° |
| Cell volume | 1387.8 ± 0.2 Å3 |
| Cell temperature | 273 ± 2 K |
| Ambient diffraction temperature | 273 ± 2 K |
| Number of distinct elements | 6 |
| Space group number | 13 |
| Hermann-Mauguin space group symbol | P 1 2/c 1 |
| Hall space group symbol | -P 2yc |
| Residual factor for all reflections | 0.0392 |
| Residual factor for significantly intense reflections | 0.032 |
| Weighted residual factors for significantly intense reflections | 0.0839 |
| Weighted residual factors for all reflections included in the refinement | 0.0879 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.046 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 250908 (current) | 2020-04-18 | cif/ Adding structures of 7240333, 7240334 via cif-deposit CGI script. |
7240334.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.