Crystallography Open Database
- COD Home
- Accessing COD Data
- Add Your Data
- Documentation
Information card for entry 1564665
Preview
Coordinates | 1564665.cif |
---|---|
Original paper (by DOI) | HTML |
Formula | C54 H78 Am2 N12 O6 |
---|---|
Calculated formula | C54 H78 Am2 N12 O6 |
Title of publication | Complexation and redox chemistry of neptunium, plutonium and americium with a hydroxylaminato ligand |
Authors of publication | Su, Jing; Cheisson, Thibault; McSkimming, Alex; Goodwin, Conrad A. P.; DiMucci, Ida M.; Albrecht-Schönzart, Thomas; Scott, Brian L.; Batista, Enrique R.; Gaunt, Andrew J.; Kozimor, Stosh A.; Yang, Ping; Schelter, Eric J. |
Journal of publication | Chemical Science |
Year of publication | 2021 |
a | 12.9096 ± 0.0017 Å |
b | 16.627 ± 0.002 Å |
c | 13.5557 ± 0.0018 Å |
α | 90° |
β | 101.146 ± 0.0016° |
γ | 90° |
Cell volume | 2854.8 ± 0.6 Å3 |
Cell temperature | 100 ± 1 K |
Ambient diffraction temperature | 100 ± 1 K |
Number of distinct elements | 5 |
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 | 0.0534 |
Residual factor for significantly intense reflections | 0.0324 |
Weighted residual factors for significantly intense reflections | 0.0611 |
Weighted residual factors for all reflections included in the refinement | 0.0668 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.04 |
Diffraction radiation wavelength | 0.71073 Å |
Diffraction radiation type | MoKα |
Has coordinates | Yes |
Has disorder | Yes |
Has Fobs | No |
For the version history of this entry, please navigate to main COD server.
The link is: https://www.crystallography.net/1564665.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.