Crystallography Open Database
- COD Home
- Accessing COD Data
- Add Your Data
- Documentation
Information card for entry 7702635
Preview
Coordinates | 7702635.cif |
---|---|
Original paper (by DOI) | HTML |
Formula | C18 H48 Cl3 F6 Mo3 P7 Se4 |
---|---|
Calculated formula | C18 H48 Cl3 F6 Mo3 P7 Se4 |
Title of publication | Transition metal incorporation into seleno-bridged cubane type clusters of molybdenum and tungsten. X-Ray crystal structures of the first [Mo3CuSe4] derivatives† |
Authors of publication | Llusar, Rosa; Uriel, Santiago; Vicent, Cristian |
Journal of publication | Journal of the Chemical Society, Dalton Transactions |
Year of publication | 2001 |
Journal issue | 19 |
Pages of publication | 2813 |
a | 20.9212 ± 0.001 Å |
b | 20.9212 ± 0.001 Å |
c | 20.9212 ± 0.001 Å |
α | 90° |
β | 90° |
γ | 90° |
Cell volume | 9157.1 ± 0.8 Å3 |
Cell temperature | 293 ± 2 K |
Ambient diffraction temperature | 293 ± 2 K |
Number of distinct elements | 7 |
Space group number | 197 |
Hermann-Mauguin space group symbol | I 2 3 |
Hall space group symbol | I 2 2 3 |
Residual factor for all reflections | 0.0521 |
Residual factor for significantly intense reflections | 0.0503 |
Weighted residual factors for significantly intense reflections | 0.1427 |
Weighted residual factors for all reflections included in the refinement | 0.1436 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.207 |
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/7702635.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.