Crystallography Open Database
- COD Home
- Accessing COD Data
- Add Your Data
- Documentation
Information card for entry 7039506
Preview
| Coordinates | 7039506.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C15 H25 B Cl5 Ga N P |
|---|---|
| Calculated formula | C15 H25 B Cl5 Ga N P |
| SMILES | [P]([Ga](Cl)(Cl)Cl)(C1[B]([n]2c1cccc2C)(Cl)Cl)(C(C)(C)C)C(C)(C)C |
| Title of publication | Versatile coordination of a reactive P,N-ligand toward boron, aluminum and gallium and interconversion reactivity. |
| Authors of publication | Devillard, M.; Alvarez Lamsfus, C.; Vreeken, V.; Maron, L.; van der Vlugt, J. I. |
| Journal of publication | Dalton transactions (Cambridge, England : 2003) |
| Year of publication | 2016 |
| Journal volume | 45 |
| Journal issue | 27 |
| Pages of publication | 10989 - 10998 |
| a | 8.437 ± 0.0004 Å |
| b | 8.7139 ± 0.0004 Å |
| c | 16.7028 ± 0.0007 Å |
| α | 87.327 ± 0.002° |
| β | 80.82 ± 0.002° |
| γ | 63.202 ± 0.002° |
| Cell volume | 1081.61 ± 0.09 Å3 |
| Cell temperature | 150 ± 2 K |
| Ambient diffraction temperature | 150 ± 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 | 0.0491 |
| Residual factor for significantly intense reflections | 0.0321 |
| Weighted residual factors for significantly intense reflections | 0.0628 |
| Weighted residual factors for all reflections included in the refinement | 0.0685 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.008 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
For the version history of this entry, please navigate to main COD server.
The link is: https://www.crystallography.net/7039506.html
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.