Crystallography Open Database
- COD Home
- Accessing COD Data
- Add Your Data
- Documentation
Information card for entry 7218789
Preview
| Coordinates | 7218789.cif |
|---|---|
| Original paper (by DOI) | HTML |
| External links | PubChem |
| Chemical name | [Pt(bpy){NH=C(pz)NC(Ph)=NH}]BF4 |
|---|---|
| Formula | C21 H18 B F4 N7 Pt |
| Calculated formula | C21 H18 B F4 N7 Pt |
| SMILES | [Pt]12([n]3c(c4[n]2cccc4)cccc3)NC(=NC(=[NH]1)c1ccccc1)n1nccc1.[B](F)(F)(F)[F-] |
| Title of publication | Highly luminescent imidoylamidinato platinum(ii) complexes formed by the coupling of 1H-pyrazole-1-carboxamidine with nitriles used as reaction solvents |
| Authors of publication | Tanaka, Tomohiro; Nouchi, Rie; Nakao, Yoshihide; Arikawa, Yasuhiro; Umakoshi, Keisuke |
| Journal of publication | RSC Adv. |
| Year of publication | 2014 |
| Journal volume | 4 |
| Journal issue | 107 |
| Pages of publication | 62186 |
| a | 7.5855 ± 0.0015 Å |
| b | 13.848 ± 0.003 Å |
| c | 20.627 ± 0.004 Å |
| α | 90° |
| β | 94.433 ± 0.003° |
| γ | 90° |
| Cell volume | 2160.3 ± 0.8 Å3 |
| Cell temperature | 93 K |
| Ambient diffraction temperature | 93 K |
| Number of distinct elements | 6 |
| Space group number | 14 |
| Hermann-Mauguin space group symbol | P 1 21/n 1 |
| Hall space group symbol | -P 2yn |
| Residual factor for significantly intense reflections | 0.0426 |
| Weighted residual factors for all reflections included in the refinement | 0.0972 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.128 |
| Diffraction radiation wavelength | 0.71075 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 301864 (current) | 2025-08-22 | Add cross-references to PubChem compounds in COD range 7/21/ Each referenced PubChem compound corresponds to the full crystal structure. |
7218789.cif |
| 180518 | 2016-03-26 | cif/7/21/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 7/21/87. |
7218789.cif |
| 127513 | 2014-11-19 | cif/ Adding structures of 7218787, 7218788, 7218789, 7218790 via cif-deposit CGI script. |
7218789.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.