Crystallography Open Database
- COD Home
- Accessing COD Data
- Add Your Data
- Documentation
Information card for entry 4069796
Preview
Coordinates | 4069796.cif |
---|---|
Original paper (by DOI) | HTML |
Common name | 2D, (dtbpe)Pt(C6D5)D |
---|---|
Formula | C24 H40 D6 P2 Pt |
Calculated formula | C24 H46 P2 Pt |
SMILES | [PtH]1([P](C(C)(C)C)(C(C)(C)C)CC[P]1(C(C)(C)C)C(C)(C)C)c1ccccc1 |
Title of publication | Reactivity Differences of Pt0Phosphine Complexes in C−C Bond Activation of Asymmetric Acetylenes |
Authors of publication | Gunay, Ahmet; Müller, Christian; Lachicotte, Rene J.; Brennessel, William W.; Jones, William D. |
Journal of publication | Organometallics |
Year of publication | 2009 |
Journal volume | 28 |
Journal issue | 22 |
Pages of publication | 6524 |
a | 11.0709 ± 0.0011 Å |
b | 15.399 ± 0.0016 Å |
c | 16.0805 ± 0.0016 Å |
α | 78.588 ± 0.001° |
β | 85.81 ± 0.001° |
γ | 72.44 ± 0.001° |
Cell volume | 2561.7 ± 0.4 Å3 |
Cell temperature | 100 ± 0.1 K |
Ambient diffraction temperature | 100 ± 0.1 K |
Number of distinct elements | 5 |
Space group number | 2 |
Hermann-Mauguin space group symbol | P -1 |
Hall space group symbol | -P 1 |
Residual factor for all reflections | 0.055 |
Residual factor for significantly intense reflections | 0.0361 |
Weighted residual factors for significantly intense reflections | 0.0778 |
Weighted residual factors for all reflections included in the refinement | 0.0851 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.044 |
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/4069796.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.