Crystallography Open Database
- COD Home
- Accessing COD Data
- Add Your Data
- Documentation
Information card for entry 4517156
Preview
Coordinates | 4517156.cif |
---|---|
Original paper (by DOI) | HTML |
Formula | C18 H30 N3 Nd O12 |
---|---|
Calculated formula | C18 H30 N3 Nd O12 |
SMILES | C1(=O)C[O]2CC(N(C)C)=[O][Nd]34562(O1)(OC(=O)C[O]3CC(N(C)C)=[O]4)OC(=O)C[O]5CC(N(C)C)=[O]6 |
Title of publication | Selective Extraction of Light Lanthanides(III) by N,N-Di(2-ethylhexyl)-diglycolamic Acid: A Comparative Study with N,N-Dimethyl-diglycolamic Acid as a Chelator in Aqueous Solutions |
Authors of publication | Ibrahim, Sherif M.; Zhang, Yan; Xue, Yun; Yang, Suliang; Ma, Fuqiu; Gao, Yang; Zhou, Yu; Tian, Guoxin |
Journal of publication | ACS Omega |
Year of publication | 2019 |
a | 9.5238 ± 0.0004 Å |
b | 12.2283 ± 0.0006 Å |
c | 13.4495 ± 0.0006 Å |
α | 79.596 ± 0.004° |
β | 80.582 ± 0.004° |
γ | 88.007 ± 0.004° |
Cell volume | 1519.79 ± 0.12 Å3 |
Cell temperature | 100 ± 0.1 K |
Ambient diffraction temperature | 100 ± 0.1 K |
Number of distinct elements | 5 |
Space group number | 2 |
Hermann-Mauguin space group symbol | P -1 |
Hall space group symbol | -P 1 |
Residual factor for all reflections | 0.0389 |
Residual factor for significantly intense reflections | 0.0321 |
Weighted residual factors for significantly intense reflections | 0.0561 |
Weighted residual factors for all reflections included in the refinement | 0.0586 |
Goodness-of-fit parameter for all reflections included in the refinement | 0.993 |
Diffraction radiation probe | x-ray |
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/4517156.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.