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Information card for entry 1507935
Preview
Coordinates | 1507935.cif |
---|---|
Original paper (by DOI) | HTML |
Formula | C56 H71 I2 N2 O P2 Si2 U |
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Calculated formula | C35 H47 I2 N2 O P2 Si2 U |
SMILES | [U]1(I)(I)([N]([Si](C)(C)C)=P(c2ccccc2)(c2ccccc2)C=P(c2ccccc2)(c2ccccc2)N1[Si](C)(C)C)[O]1CCCC1 |
Title of publication | A delocalized arene-bridged diuranium single-molecule magnet. |
Authors of publication | Mills, David P.; Moro, Fabrizio; McMaster, Jonathan; van Slageren, Joris; Lewis, William; Blake, Alexander J.; Liddle, Stephen T. |
Journal of publication | Nature chemistry |
Year of publication | 2011 |
Journal volume | 3 |
Journal issue | 6 |
Pages of publication | 454 - 460 |
a | 9.836 ± 0.003 Å |
b | 12.37 ± 0.003 Å |
c | 22.185 ± 0.006 Å |
α | 74.697 ± 0.004° |
β | 78.713 ± 0.004° |
γ | 81.039 ± 0.004° |
Cell volume | 2537.7 ± 1.2 Å3 |
Cell temperature | 150 ± 2 K |
Ambient diffraction temperature | 150 ± 2 K |
Number of distinct elements | 8 |
Space group number | 2 |
Hermann-Mauguin space group symbol | P -1 |
Hall space group symbol | -P 1 |
Residual factor for all reflections | 0.0863 |
Residual factor for significantly intense reflections | 0.064 |
Weighted residual factors for significantly intense reflections | 0.1555 |
Weighted residual factors for all reflections included in the refinement | 0.1648 |
Goodness-of-fit parameter for all reflections included in the refinement | 0.956 |
Diffraction radiation wavelength | 0.71073 Å |
Diffraction radiation type | MoKα |
Has coordinates | Yes |
Has disorder | No |
Has Fobs | No |
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The link is: https://www.crystallography.net/1507935.html
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