Crystallography Open Database
- COD Home
- Accessing COD Data
- Add Your Data
- Documentation
Information card for entry 7034484
Preview
| Coordinates | 7034484.cif |
|---|---|
| Original paper (by DOI) | HTML |
| External links | PubChem |
| Formula | C34 H31 N3 O3 |
|---|---|
| Calculated formula | C34 H31 N3 O3 |
| Title of publication | Study of the one-photon and two-photon properties of two water-soluble terpyridines and their zinc complexes. |
| Authors of publication | Shi, Pengfei; Jiang, Qin; Zhao, Xuesong; Zhang, Qiong; Tian, Yupeng |
| Journal of publication | Dalton transactions (Cambridge, England : 2003) |
| Year of publication | 2015 |
| Journal volume | 44 |
| Journal issue | 17 |
| Pages of publication | 8041 - 8048 |
| a | 21.569 ± 0.002 Å |
| b | 11.9264 ± 0.0013 Å |
| c | 11.1252 ± 0.0009 Å |
| α | 90° |
| β | 100.59 ± 0.01° |
| γ | 90° |
| Cell volume | 2813.1 ± 0.5 Å3 |
| Cell temperature | 293 ± 2 K |
| Ambient diffraction temperature | 293 ± 2 K |
| Number of distinct elements | 4 |
| 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 | 0.2115 |
| Residual factor for significantly intense reflections | 0.122 |
| Weighted residual factors for significantly intense reflections | 0.3143 |
| Weighted residual factors for all reflections included in the refinement | 0.3825 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.033 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | Yes |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 301849 (current) | 2025-08-21 | Add cross-references to PubChem compounds in COD range 7/03/ Each referenced PubChem compound corresponds to the full crystal structure. |
7034484.cif |
| 180050 | 2016-03-25 | cif/7/03/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 7/03/44. |
7034484.cif |
| 138759 | 2015-06-07 | cif/ Updating files of 7034481, 7034482, 7034483, 7034484 Original log message: Adding full bibliography for 7034481--7034484.cif. |
7034484.cif |
| 134174 | 2015-03-20 | cif/ Adding structures of 7034481, 7034482, 7034483, 7034484 via cif-deposit CGI script. |
7034484.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.