Crystallography Open Database
- COD Home
- Accessing COD Data
- Add Your Data
- Documentation
Information card for entry 4063433
Preview
Coordinates | 4063433.cif |
---|---|
Original paper (by DOI) | HTML |
Formula | C45.5 H61 Al Cl3 N6 O3.5 |
---|---|
Calculated formula | C45.5 H61 Al Cl3 N6 O3.5 |
Title of publication | Synthesis, Structures, Photoluminescent Behaviors, and DFT Studies of Novel Aluminum Complexes Containing Phenoxybenzotriazole Derivatives |
Authors of publication | Lee, Junseong; Kim, So Han; Lee, Kang Mun; Hwang, Kyu Young; Kim, Hyoseok; Huh, Jung Oh; Kim, Da Jung; Lee, Yoon Sup; Do, Youngkyu; Kim, Youngjo |
Journal of publication | Organometallics |
Year of publication | 2010 |
Journal volume | 29 |
Journal issue | 2 |
Pages of publication | 347 |
a | 17.8534 ± 0.0014 Å |
b | 21.9402 ± 0.0017 Å |
c | 24.7375 ± 0.0018 Å |
α | 90° |
β | 90° |
γ | 90° |
Cell volume | 9689.9 ± 1.3 Å3 |
Cell temperature | 296 ± 2 K |
Ambient diffraction temperature | 296 ± 2 K |
Number of distinct elements | 6 |
Space group number | 37 |
Hermann-Mauguin space group symbol | C c c 2 |
Hall space group symbol | C 2 -2c |
Residual factor for all reflections | 0.1456 |
Residual factor for significantly intense reflections | 0.0792 |
Weighted residual factors for significantly intense reflections | 0.1893 |
Weighted residual factors for all reflections included in the refinement | 0.2288 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.03 |
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/4063433.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.