Crystallography Open Database
- COD Home
- Accessing COD Data
- Add Your Data
- Documentation
Information card for entry 1557881
Preview
Coordinates | 1557881.cif |
---|---|
Original paper (by DOI) | HTML |
Common name | 1-methy1-4-(4-dimethylpheny1)-2,6-diphenylpyridinium perchlorate |
---|---|
Formula | C26 H25 Cl N2 O4 |
Calculated formula | C26 Cl N2 O4 |
Title of publication | Substituent Effects on the Geometry of the Pyridine Ring in 1-Methyl-4-(4-R-phenyl)-2,6-diphenylpyridinium Perchlorates |
Authors of publication | Anulewicz, Romana; Bak, Tomasz; Cyranski, Michal; Krygowski, Tadeusz Marek; Pawlak, Dorota; Pniewska, Barbara; Rasala, Danuta; Gawinecki, Ryszard |
Journal of publication | Acta Chemica Scandinavica |
Year of publication | 1995 |
Journal volume | 49 |
Pages of publication | 515 - 523 |
a | 7.979 ± 0.004 Å |
b | 17.892 ± 0.008 Å |
c | 16.954 ± 0.008 Å |
α | 90° |
β | 97.52 ± 0.04° |
γ | 90° |
Cell volume | 2400 ± 2 Å3 |
Ambient diffraction temperature | 293 K |
Number of distinct elements | 5 |
Space group number | 14 |
Hermann-Mauguin space group symbol | P 1 21/n 1 |
Hall space group symbol | -P 2yn |
Residual factor for all reflections | 0.1178 |
Residual factor for significantly intense reflections | 0.0753 |
Weighted residual factors for significantly intense reflections | 0.2069 |
Weighted residual factors for all reflections included in the refinement | 0.2655 |
Diffraction radiation probe | x-ray |
Diffraction radiation wavelength | 1.5418 Å |
Diffraction radiation type | CuKα |
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/1557881.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.