Crystallography Open Database
- COD Home
- Accessing COD Data
- Add Your Data
- Documentation
Information card for entry 4089528
Preview
Coordinates | 4089528.cif |
---|---|
Original paper (by DOI) | HTML |
Formula | C27 H28 As2 O15 P2 W3 |
---|---|
Calculated formula | C27 H28 As2 O15 P2 W3 |
SMILES | [W]([P]([As]1[W]([As]1[P]([W](C#[O])(C#[O])(C#[O])(C#[O])C#[O])(C(C)C)C(C)C)(C#[O])(C#[O])(C#[O])(C#[O])C#[O])(C(C)C)C(C)C)(C#[O])(C#[O])(C#[O])(C#[O])C#[O] |
Title of publication | Versatile Reactivity of Bridged Pentelidene Complexes toward Secondary and Tertiary Phosphines |
Authors of publication | Stubenhofer, Markus; Kuntz, Christian; Bodensteiner, Michael; Timoshkin, Alexey Y.; Scheer, Manfred |
Journal of publication | Organometallics |
Year of publication | 2013 |
Journal volume | 32 |
Journal issue | 12 |
Pages of publication | 3521 |
a | 15.5609 ± 0.0001 Å |
b | 20.6512 ± 0.0001 Å |
c | 11.7678 ± 0.0001 Å |
α | 90° |
β | 96.886 ± 0.001° |
γ | 90° |
Cell volume | 3754.32 ± 0.04 Å3 |
Cell temperature | 123 ± 1 K |
Ambient diffraction temperature | 123 ± 1 K |
Number of distinct elements | 6 |
Space group number | 14 |
Hermann-Mauguin space group symbol | P 1 21/c 1 |
Hall space group symbol | -P 2ybc |
Residual factor for all reflections | 0.0312 |
Residual factor for significantly intense reflections | 0.0267 |
Weighted residual factors for significantly intense reflections | 0.0651 |
Weighted residual factors for all reflections included in the refinement | 0.0671 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.04 |
Diffraction radiation probe | x-ray |
Diffraction radiation wavelength | 1.54178 Å |
Diffraction radiation type | CuKα |
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/4089528.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.