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Information card for entry 4084180
Preview
Coordinates | 4084180.cif |
---|---|
Original paper (by DOI) | HTML |
Formula | C50 H41 As2 Cl N2 O Ru S |
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Calculated formula | C50 H41 As2 Cl N2 O Ru S |
SMILES | [Ru]1([n]2ccccc2C(=Nc2ccc(C)cc2)S1)([As](c1ccccc1)(c1ccccc1)c1ccccc1)([As](c1ccccc1)(c1ccccc1)c1ccccc1)(Cl)C#[O] |
Title of publication | Direct Synthesis of Amides from Coupling of Alcohols and Amines Catalyzed by Ruthenium(II) Thiocarboxamide Complexes under Aerobic Conditions |
Authors of publication | Sindhuja, Elangovan; Ramesh, Rengan; Balaji, Sundarraman; Liu, Yu |
Journal of publication | Organometallics |
Year of publication | 2014 |
Journal volume | 33 |
Journal issue | 16 |
Pages of publication | 4269 |
a | 13.018 ± 0.003 Å |
b | 20.722 ± 0.004 Å |
c | 17.252 ± 0.004 Å |
α | 90° |
β | 109.05 ± 0.03° |
γ | 90° |
Cell volume | 4399 ± 1.8 Å3 |
Cell temperature | 273 ± 2 K |
Ambient diffraction temperature | 273 ± 2 K |
Number of distinct elements | 8 |
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 | 0.0438 |
Residual factor for significantly intense reflections | 0.0308 |
Weighted residual factors for significantly intense reflections | 0.0732 |
Weighted residual factors for all reflections included in the refinement | 0.0788 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.024 |
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/4084180.html
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