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Information card for entry 7708900
Preview
Coordinates | 7708900.cif |
---|---|
Original paper (by DOI) | HTML |
Formula | C84 H74 Cl4 Cu F5 N2 O2 |
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Calculated formula | C84 H74 Cl4 Cu F5 N2 O2 |
Title of publication | Straightforward synthesis of [Cu(NHC)(alkynyl)] and [Cu(NHC)(thiolato)] complexes (NHC = N-heterocyclic carbene). |
Authors of publication | Ibni Hashim, Ishfaq; Scattolin, Thomas; Tzouras, Nikolaos V.; Bourda, Laurens; Van Hecke, Kristof; Ritacco, Ida; Caporaso, Lucia; Cavallo, Luigi; Nolan, Steven P.; Cazin, Catherine S. J. |
Journal of publication | Dalton transactions (Cambridge, England : 2003) |
Year of publication | 2021 |
Journal volume | 51 |
Journal issue | 1 |
Pages of publication | 231 - 240 |
a | 16.1936 ± 0.0002 Å |
b | 24.2823 ± 0.0002 Å |
c | 18.3609 ± 0.0002 Å |
α | 90° |
β | 92.918 ± 0.001° |
γ | 90° |
Cell volume | 7210.47 ± 0.13 Å3 |
Cell temperature | 100 ± 0.1 K |
Ambient diffraction temperature | 100 ± 0.1 K |
Number of distinct elements | 7 |
Space group number | 14 |
Hermann-Mauguin space group symbol | P 1 21/n 1 |
Hall space group symbol | -P 2yn |
Residual factor for all reflections | 0.1011 |
Residual factor for significantly intense reflections | 0.0724 |
Weighted residual factors for significantly intense reflections | 0.1948 |
Weighted residual factors for all reflections included in the refinement | 0.2181 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.031 |
Diffraction radiation probe | x-ray |
Diffraction radiation wavelength | 1.54184 Å |
Diffraction radiation type | CuKα |
Has coordinates | Yes |
Has disorder | No |
Has Fobs | No |
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