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Information card for entry 7126045
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Coordinates | 7126045.cif |
---|---|
Original paper (by DOI) | HTML |
Formula | C54 H72 As N3 |
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Calculated formula | C54 H72 As N3 |
Title of publication | Isolation of singlet carbene derived 2-arsa-1,3-butadiene radical cations and dications. |
Authors of publication | Sharma, Mahendra K.; Blomeyer, Sebastian; Neumann, Beate; Stammler, Hans-Georg; Hinz, Alexander; van Gastel, Maurice; Ghadwal, Rajendra S. |
Journal of publication | Chemical communications (Cambridge, England) |
Year of publication | 2020 |
Journal volume | 56 |
Journal issue | 24 |
Pages of publication | 3575 - 3578 |
a | 12.59029 ± 0.00007 Å |
b | 15.93625 ± 0.00008 Å |
c | 23.78509 ± 0.00012 Å |
α | 90° |
β | 93.231 ± 0.0005° |
γ | 90° |
Cell volume | 4764.7 ± 0.04 Å3 |
Cell temperature | 100 ± 0.1 K |
Ambient diffraction temperature | 100 ± 0.1 K |
Number of distinct elements | 4 |
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 | 0.0307 |
Residual factor for significantly intense reflections | 0.0269 |
Weighted residual factors for significantly intense reflections | 0.0677 |
Weighted residual factors for all reflections included in the refinement | 0.0705 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.026 |
Diffraction radiation probe | x-ray |
Diffraction radiation wavelength | 1.54184 Å |
Diffraction radiation type | CuKα |
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/7126045.html
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Users of the data should acknowledge the original authors of the
structural data.