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Information card for entry 4081303
Preview
Coordinates | 4081303.cif |
---|---|
Original paper (by DOI) | HTML |
Formula | C22 H30 U |
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Calculated formula | C22 H30 U |
SMILES | [U]123456789%10%11%12%13([c]%14([c]4([c]3([c]2([c]1%14C)C)C)C)C)([CH]1=[CH]%11[CH]%10=[CH]9[CH]8=[CH]7[CH]6=[CH]51)[CH2]=[C]%12(C%13)C |
Title of publication | Reactivity of U3+Metallocene Allyl Complexes Leads to a Nanometer-Sized Uranium Carbonate, [(C5Me5)2U]6(μ-κ1:κ2-CO3)6 |
Authors of publication | Webster, Christopher L.; Ziller, Joseph W.; Evans, William J. |
Journal of publication | Organometallics |
Year of publication | 2013 |
Journal volume | 32 |
Journal issue | 17 |
Pages of publication | 4820 |
a | 8.8131 ± 0.0004 Å |
b | 14.2385 ± 0.0006 Å |
c | 16.0147 ± 0.0006 Å |
α | 106.657 ± 0.0005° |
β | 98.8404 ± 0.0005° |
γ | 90.4651 ± 0.0005° |
Cell volume | 1899.52 ± 0.14 Å3 |
Cell temperature | 83 ± 2 K |
Ambient diffraction temperature | 83 ± 2 K |
Number of distinct elements | 3 |
Space group number | 2 |
Hermann-Mauguin space group symbol | P -1 |
Hall space group symbol | -P 1 |
Residual factor for all reflections | 0.0257 |
Residual factor for significantly intense reflections | 0.0178 |
Weighted residual factors for significantly intense reflections | 0.0375 |
Weighted residual factors for all reflections included in the refinement | 0.0396 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.02 |
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/4081303.html
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Users of the data should acknowledge the original authors of the
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