Crystallography Open Database
- COD Home
- Accessing COD Data
- Add Your Data
- Documentation
Information card for entry 7043532
Preview
| Coordinates | 7043532.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C62 H63 Cl N O4 P Pd |
|---|---|
| Calculated formula | C62 H63 Cl N O4 P Pd |
| Title of publication | Calix[4]arene-fused phospholes |
| Authors of publication | Elaieb, Fethi; Sémeril, David; Matt, Dominique; Pfeffer, Michel; Bouit, Pierre-Antoine; Hissler, Muriel; Gourlaouen, Christophe; Harrowfield, Jack |
| Journal of publication | Dalton Trans. |
| Year of publication | 2017 |
| a | 9.8908 ± 0.0007 Å |
| b | 19.6964 ± 0.0014 Å |
| c | 27.456 ± 0.002 Å |
| α | 94.474 ± 0.002° |
| β | 90.746 ± 0.002° |
| γ | 91.791 ± 0.002° |
| Cell volume | 5329.2 ± 0.7 Å3 |
| Cell temperature | 173 ± 2 K |
| Ambient diffraction temperature | 173 ± 2 K |
| Number of distinct elements | 7 |
| Space group number | 2 |
| Hermann-Mauguin space group symbol | P -1 |
| Hall space group symbol | -P 1 |
| Residual factor for all reflections | 0.1495 |
| Residual factor for significantly intense reflections | 0.0782 |
| Weighted residual factors for significantly intense reflections | 0.1526 |
| Weighted residual factors for all reflections included in the refinement | 0.1776 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.059 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | Yes |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 198571 (current) | 2017-07-08 | cif/ Adding structures of 7043530, 7043531, 7043532, 7043533 via cif-deposit CGI script. |
7043532.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.