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Information card for entry 4350635
Preview
Coordinates | 4350635.cif |
---|---|
Original paper (by DOI) | HTML |
Common name | [(C6F5)2TAP]CuCO(CH3CN) |
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Formula | C23 H3 Cu F24 N4 O |
Calculated formula | C23 H3 Cu F24 N4 O |
SMILES | [Cu]1([N](=C(N=C(N1c1c(c(c(c(c1F)F)F)F)F)C(C(C(F)(F)F)(F)F)(F)F)C(C(C(F)(F)F)(F)F)(F)F)c1c(c(c(c(c1F)F)F)F)F)([N]#CC)C#[O] |
Title of publication | Syntheses of highly fluorinated 1,3,5-triazapentadienyl ligands and their use in the isolation of copper(I)-carbonyl and copper(I)-ethylene complexes. |
Authors of publication | Dias, H. V. Rasika; Singh, Shreeyukta; Flores, Jaime A. |
Journal of publication | Inorganic chemistry |
Year of publication | 2006 |
Journal volume | 45 |
Journal issue | 22 |
Pages of publication | 8859 - 8861 |
a | 10.5092 ± 0.0004 Å |
b | 12.5716 ± 0.0005 Å |
c | 21.8262 ± 0.0009 Å |
α | 90° |
β | 97.515 ± 0.001° |
γ | 90° |
Cell volume | 2858.9 ± 0.2 Å3 |
Cell temperature | 100 ± 2 K |
Ambient diffraction temperature | 100 ± 2 K |
Number of distinct elements | 6 |
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 | 0.0322 |
Residual factor for significantly intense reflections | 0.03 |
Weighted residual factors for significantly intense reflections | 0.0812 |
Weighted residual factors for all reflections included in the refinement | 0.083 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.06 |
Diffraction radiation wavelength | 0.71073 Å |
Diffraction radiation type | MoKα |
Has coordinates | Yes |
Has disorder | No |
Has Fobs | No |
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The link is: https://www.crystallography.net/4350635.html
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