Crystallography Open Database
- COD Home
- Accessing COD Data
- Add Your Data
- Documentation
Information card for entry 4330883
Preview
| Coordinates | 4330883.cif |
|---|---|
| Original paper (by DOI) | HTML |
| External links | PubChem |
| Common name | Compound X |
|---|---|
| Formula | C32.25 H17.5 Cl0.5 F5 N2 Pt |
| Calculated formula | C32.25 H17.5 Cl0.5 F5 N2 Pt |
| Title of publication | Facile Metalation of Hbzq by [cis-Pt(C6F5)2(thf)2]: A Route to a Pentafluorophenyl Benzoquinolate Solvate Complex That Easily Coordinates Terminal Alkynes. Spectroscopic and Optical Properties |
| Authors of publication | Jesús R. Berenguer; Elena Lalinde; M. Teresa Moreno; Sergio Sánchez; Javier Torroba |
| Journal of publication | Inorganic Chemistry |
| Year of publication | 2012 |
| Journal volume | 51 |
| Pages of publication | 11665 - 11679 |
| a | 8.1679 ± 0.0007 Å |
| b | 12.3058 ± 0.0009 Å |
| c | 14.3251 ± 0.0007 Å |
| α | 71.521 ± 0.004° |
| β | 84.253 ± 0.005° |
| γ | 84.989 ± 0.003° |
| Cell volume | 1356.39 ± 0.17 Å3 |
| Cell temperature | 173 ± 1 K |
| Ambient diffraction temperature | 173 ± 1 K |
| Number of distinct elements | 6 |
| Space group number | 2 |
| Hermann-Mauguin space group symbol | P -1 |
| Hall space group symbol | -P 1 |
| Residual factor for all reflections | 0.0476 |
| Residual factor for significantly intense reflections | 0.0444 |
| Weighted residual factors for significantly intense reflections | 0.1151 |
| Weighted residual factors for all reflections included in the refinement | 0.1176 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.094 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 301839 (current) | 2025-08-21 | Add cross-references to PubChem compounds in COD range 4/33/ Each referenced PubChem compound corresponds to the full crystal structure. |
4330883.cif |
| 176467 | 2016-02-16 | cif/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in range 4. |
4330883.cif |
| 80342 | 2013-04-07 | cif/ Adding structures of 4330883 via cif-deposit CGI script. |
4330883.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.