Crystallography Open Database
- COD Home
- Accessing COD Data
- Add Your Data
- Documentation
Information card for entry 7706765
Preview
Coordinates | 7706765.cif |
---|---|
Original paper (by DOI) | HTML |
Chemical name | [MoOCl3(MeS(CH2)3SMe)] |
---|---|
Formula | C5 H12 Cl3 Mo O S2 |
Calculated formula | C5 H12 Cl3 Mo O S2 |
Title of publication | Synthesis, properties and structural features of molybdenum(v) oxide trichloride complexes with neutral chalcogenoether ligands. |
Authors of publication | Smith, Danielle E.; Levason, William; Powell, James; Reid, Gillian |
Journal of publication | Dalton transactions (Cambridge, England : 2003) |
Year of publication | 2021 |
Journal volume | 50 |
Journal issue | 12 |
Pages of publication | 4380 - 4389 |
a | 12.261 ± 0.0002 Å |
b | 12.7705 ± 0.0002 Å |
c | 7.6085 ± 0.0001 Å |
α | 90° |
β | 90° |
γ | 90° |
Cell volume | 1191.33 ± 0.03 Å3 |
Cell temperature | 99.98 ± 0.18 K |
Ambient diffraction temperature | 99.98 ± 0.18 K |
Number of distinct elements | 6 |
Space group number | 62 |
Hermann-Mauguin space group symbol | P n m a |
Hall space group symbol | -P 2ac 2n |
Residual factor for all reflections | 0.0194 |
Residual factor for significantly intense reflections | 0.0187 |
Weighted residual factors for significantly intense reflections | 0.0424 |
Weighted residual factors for all reflections included in the refinement | 0.0428 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.106 |
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/7706765.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.