Crystallography Open Database
- COD Home
- Accessing COD Data
- Add Your Data
- Documentation
Information card for entry 1564373
Preview
Coordinates | 1564373.cif |
---|---|
Original paper (by DOI) | HTML |
Formula | C80 H179 N O26 Si6 U2 |
---|---|
Calculated formula | C80 H179 N O26 Si6 U2 |
Title of publication | Nitride Protonation and NH3 Binding versus N‒H Bond Cleavage in Uranium Nitrides |
Authors of publication | Keener, Megan; Scopelliti, Rosario; Mazzanti, Marinella |
Journal of publication | Chemical Science |
Year of publication | 2021 |
a | 25.5184 ± 0.0004 Å |
b | 14.0899 ± 0.0004 Å |
c | 61.6564 ± 0.0014 Å |
α | 90° |
β | 90.99 ± 0.0019° |
γ | 90° |
Cell volume | 22165.4 ± 0.9 Å3 |
Cell temperature | 140 ± 0.1 K |
Ambient diffraction temperature | 140 ± 0.1 K |
Number of distinct elements | 6 |
Space group number | 15 |
Hermann-Mauguin space group symbol | C 1 2/c 1 |
Hall space group symbol | -C 2yc |
Residual factor for all reflections | 0.1012 |
Residual factor for significantly intense reflections | 0.0565 |
Weighted residual factors for significantly intense reflections | 0.1209 |
Weighted residual factors for all reflections included in the refinement | 0.1387 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.01 |
Diffraction radiation probe | x-ray |
Diffraction radiation wavelength | 1.54184 Å |
Diffraction radiation type | CuKα |
Has coordinates | Yes |
Has disorder | Yes |
Has Fobs | No |
Revision | Date | Message | Files |
---|---|---|---|
268126 (current) | 2021-08-19 | cif/ Adding structures of 1564372, 1564373, 1564374, 1564375, 1564376, 1564377 via cif-deposit CGI script. |
1564373.cif |
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.