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Information card for entry 4088419
Preview
Coordinates | 4088419.cif |
---|---|
Original paper (by DOI) | HTML |
Formula | C24 H23 Cu Fe I N O |
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Calculated formula | C24 H23 Cu Fe I N O |
SMILES | O1C2=[N]([Cu]3(I)[C]([c]45[Fe]6789%10%11%12([cH]4[cH]6[cH]7[cH]58)[cH]4[cH]9[cH]%10[cH]%11[cH]%124)#[C]3c3ccccc23)[C@H](C1)C(C)C |
Title of publication | Unprecedented Formation of π-Copper Complexes during Sonogashira Coupling: Synthesis of a Unique, Recyclable, Ethynyl Ferrocene Derived Cu(I) Specific Ligand |
Authors of publication | Deb, Mayukh; Kumar, Dheeraj; Singh, Jatinder; Elias, Anil J. |
Journal of publication | Organometallics |
Year of publication | 2016 |
Journal volume | 35 |
Journal issue | 8 |
Pages of publication | 1086 |
a | 9.231 ± 0.0013 Å |
b | 13.687 ± 0.002 Å |
c | 17.612 ± 0.003 Å |
α | 90° |
β | 90° |
γ | 90° |
Cell volume | 2225.2 ± 0.6 Å3 |
Cell temperature | 298 ± 2 K |
Ambient diffraction temperature | 298 ± 2 K |
Number of distinct elements | 7 |
Space group number | 19 |
Hermann-Mauguin space group symbol | P 21 21 21 |
Hall space group symbol | P 2ac 2ab |
Residual factor for all reflections | 0.0567 |
Residual factor for significantly intense reflections | 0.0536 |
Weighted residual factors for significantly intense reflections | 0.1121 |
Weighted residual factors for all reflections included in the refinement | 0.1135 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.293 |
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/4088419.html
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