Crystallography Open Database
- COD Home
- Accessing COD Data
- Add Your Data
- Documentation
Information card for entry 1571026
Preview
Coordinates | 1571026.cif |
---|---|
Original paper (by DOI) | HTML |
Formula | C38 H45.01 B2 Li N9 O1.5 |
---|---|
Calculated formula | C38 H44.996 B2 Li N9 O1.498 |
Title of publication | Oxidation-induced ambiphilicity triggers N-N bond formation and dinitrogen release in octahedral terminal molybdenum(v) nitrido complexes. |
Authors of publication | Almquist, C. Christopher; Rajeshkumar, Thayalan; Jayaweera, H. D. A. Chathumal; Removski, Nicole; Zhou, Wen; Gelfand, Benjamin S.; Maron, Laurent; Piers, Warren E. |
Journal of publication | Chemical science |
Year of publication | 2024 |
Journal volume | 15 |
Journal issue | 14 |
Pages of publication | 5152 - 5162 |
a | 9.4559 ± 0.0002 Å |
b | 13.3234 ± 0.0002 Å |
c | 15.6012 ± 0.0004 Å |
α | 105.885 ± 0.001° |
β | 98.659 ± 0.002° |
γ | 93.937 ± 0.002° |
Cell volume | 1856.39 ± 0.07 Å3 |
Cell temperature | 173.15 K |
Ambient diffraction temperature | 173.15 K |
Number of distinct elements | 6 |
Space group number | 2 |
Hermann-Mauguin space group symbol | P -1 |
Hall space group symbol | -P 1 |
Residual factor for all reflections | 0.0763 |
Residual factor for significantly intense reflections | 0.0701 |
Weighted residual factors for significantly intense reflections | 0.1867 |
Weighted residual factors for all reflections included in the refinement | 0.1929 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.047 |
Diffraction radiation wavelength | 1.54178 Å |
Diffraction radiation type | CuKα |
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/1571026.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.