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Information card for entry 7057251
Preview
Coordinates | 7057251.cif |
---|---|
Original paper (by DOI) | HTML |
Formula | C62 H53 Cl2 N3 O2 Pd |
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Calculated formula | C62 H53 Cl2 N3 O2 Pd |
Title of publication | Highly active NHC‒Pd(ii) complexes for cross coupling of aryl chlorides and arylboronic acids: an investigation of the effect of remote bulky groups |
Authors of publication | Han, Fangwai; Xu, Ying; Zhu, Rongjiao; Liu, Guiyan; Chen, Chen; Wang, Jianhui |
Journal of publication | New Journal of Chemistry |
Year of publication | 2018 |
Journal volume | 42 |
Journal issue | 9 |
Pages of publication | 7422 |
a | 12.6752 ± 0.0009 Å |
b | 13.2902 ± 0.0009 Å |
c | 16.9619 ± 0.0013 Å |
α | 92.605 ± 0.002° |
β | 108.986 ± 0.001° |
γ | 107.731 ± 0.001° |
Cell volume | 2540.2 ± 0.3 Å3 |
Cell temperature | 173 ± 2 K |
Ambient diffraction temperature | 173 ± 2 K |
Number of distinct elements | 6 |
Space group number | 2 |
Hermann-Mauguin space group symbol | P -1 |
Hall space group symbol | -P 1 |
Residual factor for all reflections | 0.0795 |
Residual factor for significantly intense reflections | 0.053 |
Weighted residual factors for significantly intense reflections | 0.0922 |
Weighted residual factors for all reflections included in the refinement | 0.1026 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.028 |
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/7057251.html
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