Crystallography Open Database
- COD Home
- Accessing COD Data
- Add Your Data
- Documentation
Information card for entry 4346958
Preview
Coordinates | 4346958.cif |
---|---|
Original paper (by DOI) | HTML |
Common name | Dy2(C3H3N4O2)4(NO3)2(C10N2H8)2 |
---|---|
Chemical name | 'Dy2(C3H3N4O2)4(NO3)2(C10N2H8)2' |
Formula | C32 H28 Dy2 N22 O14 |
Calculated formula | C32 H28 Dy2 N22 O14 |
SMILES | C(C1=[O][Dy]23456(ON(=[O]2)=O)([n]2ccccc2c2cccc[n]32)[O]2C(Cn3cnnn3)=[O][Dy]372([O]4C(Cn2cnnn2)=[O]5)([O]=C(Cn2cnnn2)O6)(O1)(ON(=[O]3)=O)[n]1ccccc1c1cccc[n]71)n1cnnn1 |
Title of publication | Anion Effects on Lanthanide(III) Tetrazole-1-acetate Dinuclear Complexes Showing Slow Magnetic Relaxation and Photofluorescent Emission. |
Authors of publication | Lu, Ying-Bing; Jiang, Xiao-Ming; Zhu, Shui-Dong; Du, Zi-Yi; Liu, Cai-Ming; Xie, Yong-Rong; Liu, Liang-Xian |
Journal of publication | Inorganic chemistry |
Year of publication | 2016 |
Journal volume | 55 |
Journal issue | 8 |
Pages of publication | 3738 - 3749 |
a | 9.4838 ± 0.0001 Å |
b | 20.1532 ± 0.0003 Å |
c | 11.9787 ± 0.0001 Å |
α | 90° |
β | 108.879 ± 0.001° |
γ | 90° |
Cell volume | 2166.31 ± 0.05 Å3 |
Cell temperature | 296 ± 2 K |
Ambient diffraction temperature | 296 ± 2 K |
Number of distinct elements | 5 |
Space group number | 14 |
Hermann-Mauguin space group symbol | P 1 21/c 1 |
Hall space group symbol | -P 2ybc |
Residual factor for all reflections | 0.0407 |
Residual factor for significantly intense reflections | 0.0271 |
Weighted residual factors for significantly intense reflections | 0.0536 |
Weighted residual factors for all reflections included in the refinement | 0.059 |
Goodness-of-fit parameter for all reflections included in the refinement | 1 |
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/4346958.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.