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Information card for entry 4068362
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Coordinates | 4068362.cif |
---|---|
Original paper (by DOI) | HTML |
Common name | UCI-MKT-1 |
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Formula | C48 H56 Se2 U2 |
Calculated formula | C48 H56 Se2 U2 |
SMILES | [U]123456789%10%11%12([CH]%13=[CH]3[CH]4=[CH]5[CH]1=[CH]6[CH]7=[CH]8%13)([c]1([c]9([c]%10([c]%11([c]1%12C)C)C)C)C)[Se](c1ccccc1)[U]13456789%10%11%12([CH]%13=[CH]3[CH]4=[CH]5[CH]1=[CH]6[CH]7=[CH]8%13)([c]1([c]9([c]%10([c]%11([c]1%12C)C)C)C)C)[Se]2c1ccccc1 |
Title of publication | Reductive Reactivity of the Tetravalent Uranium Complex [(η5-C5Me5)(η8-C8H8)U]2(μ-η3:η3-C8H8) |
Authors of publication | Evans, William J.; Takase, Michael K.; Ziller, Joseph W.; DiPasquale, Antonio G.; Rheingold, Arnold L. |
Journal of publication | Organometallics |
Year of publication | 2009 |
Journal volume | 28 |
Journal issue | 1 |
Pages of publication | 236 |
a | 12.191 ± 0.004 Å |
b | 17.707 ± 0.008 Å |
c | 19.051 ± 0.005 Å |
α | 90° |
β | 90° |
γ | 90° |
Cell volume | 4112 ± 3 Å3 |
Cell temperature | 208 ± 2 K |
Ambient diffraction temperature | 208 ± 2 K |
Number of distinct elements | 4 |
Space group number | 61 |
Hermann-Mauguin space group symbol | P b c a |
Hall space group symbol | -P 2ac 2ab |
Residual factor for all reflections | 0.0691 |
Residual factor for significantly intense reflections | 0.0424 |
Weighted residual factors for significantly intense reflections | 0.0941 |
Weighted residual factors for all reflections included in the refinement | 0.1066 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.007 |
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/4068362.html
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Users of the data should acknowledge the original authors of the
structural data.