Crystallography Open Database
- COD Home
- Accessing COD Data
- Add Your Data
- Documentation
Information card for entry 7154509
Preview
Jmol._Canvas2D (Jmol) "jmolApplet0"[x]
Coordinates | 7154509.cif |
---|---|
Original paper (by DOI) | HTML |
Chemical name | 2,6-Dichloro-3,5-diphenylpyridine |
---|---|
Formula | C17 H11 Cl2 N |
Calculated formula | C17 H11 Cl2 N |
SMILES | c1(nc(c(cc1c1ccccc1)c1ccccc1)Cl)Cl |
Title of publication | Synthesis of tetraarylpyridines by chemo-selective Suzuki-Miyaura reactions of 3,5-dibromo-2,6-dichloropyridine. |
Authors of publication | Reimann, Sebastian; Parpart, Silvio; Ehlers, Peter; Sharif, Muhammad; Spannenberg, Anke; Langer, Peter |
Journal of publication | Organic & biomolecular chemistry |
Year of publication | 2015 |
Journal volume | 13 |
Journal issue | 24 |
Pages of publication | 6832 - 6838 |
a | 21.3422 ± 0.0005 Å |
b | 8.1975 ± 0.0002 Å |
c | 8.0145 ± 0.0002 Å |
α | 90° |
β | 90° |
γ | 90° |
Cell volume | 1402.16 ± 0.06 Å3 |
Cell temperature | 150 ± 2 K |
Ambient diffraction temperature | 150 ± 2 K |
Number of distinct elements | 4 |
Space group number | 60 |
Hermann-Mauguin space group symbol | P b c n |
Hall space group symbol | -P 2n 2ab |
Residual factor for all reflections | 0.0269 |
Residual factor for significantly intense reflections | 0.0255 |
Weighted residual factors for significantly intense reflections | 0.0683 |
Weighted residual factors for all reflections included in the refinement | 0.07 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.082 |
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/7154509.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.