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Information card for entry 7126025
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Coordinates | 7126025.cif |
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Original paper (by DOI) | HTML |
Formula | C42 H40 Cu2 N8 |
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Calculated formula | C42 H40 Cu2 N8 |
Title of publication | Pressure-induced inclusion of neon in the crystal structure of a molecular Cu<sub>2</sub>(pacman) complex at 4.67 GPa. |
Authors of publication | Giordano, Nico; Beavers, Christine M.; Kamenev, Konstantin V.; Love, Jason B.; Pankhurst, James R.; Teat, Simon J.; Parsons, Simon |
Journal of publication | Chemical communications (Cambridge, England) |
Year of publication | 2020 |
Journal volume | 56 |
Journal issue | 23 |
Pages of publication | 3449 - 3452 |
a | 25.3657 ± 0.0015 Å |
b | 9.9388 ± 0.0006 Å |
c | 29.1779 ± 0.0017 Å |
α | 90° |
β | 92.788 ± 0.002° |
γ | 90° |
Cell volume | 7347.2 ± 0.8 Å3 |
Cell temperature | 298 ± 2 K |
Ambient diffraction temperature | 298 K |
Number of distinct elements | 4 |
Space group number | 15 |
Hermann-Mauguin space group symbol | C 1 2/c 1 |
Hall space group symbol | -C 2yc |
Residual factor for all reflections | 0.0829 |
Residual factor for significantly intense reflections | 0.0757 |
Weighted residual factors for significantly intense reflections | 0.1842 |
Weighted residual factors for all reflections included in the refinement | 0.1949 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.03 |
Diffraction radiation wavelength | 0.7749 Å |
Diffraction radiation type | synchrotron |
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/7126025.html
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Users of the data should acknowledge the original authors of the
structural data.