Crystallography Open Database
- COD Home
- Accessing COD Data
- Add Your Data
- Documentation
Information card for entry 4080893
Preview
Coordinates | 4080893.cif |
---|---|
Original paper (by DOI) | HTML |
Chemical name | Ti(O(CH2CH2NSiMe3)(CH2CH2NC(H)C(Ph)NSiMe3)NPh2 |
---|---|
Formula | C31 H44 N4 O Si2 Ti |
Calculated formula | C31 H44 N4 O Si2 Ti |
SMILES | [Ti]123([O](CCN2C=C(N1[Si](C)(C)C)c1ccc(cc1)C)CCN3[Si](C)(C)C)N(c1ccccc1)c1ccccc1 |
Title of publication | Synthesis and Reactivity of Titanium Hydrazido Complexes Supported by Diamido-Ether Ligands |
Authors of publication | Unruangsri, Junjuda; Morgan, Hannah; Schwarz, Andrew D.; Schofield, A. Daniel; Mountford, Philip |
Journal of publication | Organometallics |
Year of publication | 2013 |
Journal volume | 32 |
Journal issue | 10 |
Pages of publication | 3091 |
a | 8.6182 ± 0.0007 Å |
b | 11.8395 ± 0.0009 Å |
c | 17.0966 ± 0.0014 Å |
α | 74.409 ± 0.007° |
β | 85.427 ± 0.006° |
γ | 74.224 ± 0.007° |
Cell volume | 1616.9 ± 0.2 Å3 |
Cell temperature | 150 K |
Ambient diffraction temperature | 150 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 | 0.0446 |
Residual factor for significantly intense reflections | 0.0394 |
Weighted residual factors for all reflections | 0.0426 |
Weighted residual factors for significantly intense reflections | 0.0409 |
Weighted residual factors for all reflections included in the refinement | 0.0405 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.0298 |
Diffraction radiation wavelength | 1.54184 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/4080893.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.