Crystallography Open Database
- COD Home
- Accessing COD Data
- Add Your Data
- Documentation
Information card for entry 4328284
Preview
Coordinates | 4328284.cif |
---|---|
Original paper (by DOI) | HTML |
Formula | C30 H58 Ni O Sn3 |
---|---|
Calculated formula | C30 H58 Ni O Sn3 |
SMILES | [Ni]12345(C#[O])[c]6([cH]1[cH]2[cH]3[cH]46)[Sn]([Sn]([Sn]5(C(C)(C)C)C(C)(C)C)(C(C)(C)C)C(C)(C)C)(C(C)(C)C)C(C)(C)C |
Title of publication | Synthesis and Structure of Distanna and Tristanna Ansa Half-Sandwich Complexes of Ruthenium and Nickel |
Authors of publication | Holger Braunschweig; Rainer Dörfler; Kai Hammond; Thomas Kramer; Jan Mies; Krzysztof Radacki; Marius Schäfer |
Journal of publication | Inorganic Chemistry |
Year of publication | 2012 |
Journal volume | 51 |
Pages of publication | 1225 - 1227 |
a | 10.8423 ± 0.0006 Å |
b | 11.1459 ± 0.0006 Å |
c | 17.0318 ± 0.0009 Å |
α | 102.351 ± 0.002° |
β | 107.504 ± 0.002° |
γ | 93.868 ± 0.002° |
Cell volume | 1898.22 ± 0.18 Å3 |
Cell temperature | 100 ± 2 K |
Ambient diffraction temperature | 100 ± 2 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 | 0.021 |
Residual factor for significantly intense reflections | 0.0187 |
Weighted residual factors for significantly intense reflections | 0.0581 |
Weighted residual factors for all reflections included in the refinement | 0.0593 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.019 |
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/4328284.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.