Crystallography Open Database
- COD Home
- Accessing COD Data
- Add Your Data
- Documentation
Information card for entry 4349368
Preview
Coordinates | 4349368.cif |
---|---|
Original paper (by DOI) | HTML |
Common name | CuL1(CNAr) |
---|---|
Formula | C32 H39 Cu N4 |
Calculated formula | C32 H39 Cu N4 |
SMILES | c1(c(C(C)C)cccc1C(C)C)[N]1=C(C)C=C(C)N([Cu]1C#[N]c1c(C)cccc1C)Cc1ccccn1 |
Title of publication | Reactivity Study of Unsymmetrical β-Diketiminato Copper(I) Complexes: Effect of the Chelating Ring. |
Authors of publication | Chuang, Wan-Jung; Hsu, Sung-Po; Chand, Kuldeep; Yu, Fu-Lun; Tsai, Cheng-Long; Tseng, Yu-Hsuan; Lu, Yuh-Hsiu; Kuo, Jen-Yu; Carey, James R.; Chen, Hsuan-Ying; Chen, Hsing-Yin; Chiang, Michael Y.; Hsu, Sodio C. N. |
Journal of publication | Inorganic chemistry |
Year of publication | 2017 |
Journal volume | 56 |
Journal issue | 5 |
Pages of publication | 2722 - 2735 |
a | 8.929 ± 0.004 Å |
b | 11.703 ± 0.005 Å |
c | 14.735 ± 0.006 Å |
α | 96.328 ± 0.007° |
β | 103.92 ± 0.006° |
γ | 98.454 ± 0.006° |
Cell volume | 1461.2 ± 1.1 Å3 |
Cell temperature | 200 ± 2 K |
Ambient diffraction temperature | 200 ± 2 K |
Number of distinct elements | 4 |
Space group number | 2 |
Hermann-Mauguin space group symbol | P -1 |
Hall space group symbol | -P 1 |
Residual factor for all reflections | 0.0661 |
Residual factor for significantly intense reflections | 0.0469 |
Weighted residual factors for significantly intense reflections | 0.1219 |
Weighted residual factors for all reflections included in the refinement | 0.135 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.034 |
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/4349368.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.