Crystallography Open Database
- COD Home
- Accessing COD Data
- Add Your Data
- Documentation
Information card for entry 7227112
Preview
Coordinates | 7227112.cif |
---|---|
Original paper (by DOI) | HTML |
Formula | C14 H14 Cl2 N2 O Zn |
---|---|
Calculated formula | C14 H14 Cl2 N2 O Zn |
SMILES | [Zn]1([n]2c(cccc2)C(=[N]1c1c(OC)cccc1)C)(Cl)Cl |
Title of publication | Luminescent Properties of Zn(II) Supramolecular Framework: Easily Tunable Optical Properties by Variation of the Alkyl Substitution of (E)-N-(Pyridine-2-ylethylidyne)arylamine Ligands |
Authors of publication | Dong, Yuwei; Fan, Ruiqing; Chen, Wei; Zhang, Huijie; Song, Yang; Du, Xi; Wang, Ping; Wei, Liguo; Yang, Yulin |
Journal of publication | RSC Adv. |
Year of publication | 2016 |
a | 11.311 ± 0.003 Å |
b | 9.796 ± 0.003 Å |
c | 14.305 ± 0.004 Å |
α | 90° |
β | 106.827 ± 0.003° |
γ | 90° |
Cell volume | 1517.2 ± 0.7 Å3 |
Cell temperature | 296 ± 2 K |
Ambient diffraction temperature | 296 ± 2 K |
Number of distinct elements | 6 |
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 | 0.0479 |
Residual factor for significantly intense reflections | 0.0336 |
Weighted residual factors for significantly intense reflections | 0.0807 |
Weighted residual factors for all reflections included in the refinement | 0.0873 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.023 |
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/7227112.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.