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Information card for entry 4080265
Preview
Coordinates | 4080265.cif |
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Original paper (by DOI) | HTML |
Formula | C62 H88 N4 O2 U |
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Calculated formula | C62 H88 N4 O2 U |
SMILES | [U]1234([N](c5c(c(cc(c5)C(C)(C)C)C(C)(C)C)O2)=C(C=C(N1c1c(cccc1C(C)C)C(C)C)C)C)[N](c1c(c(cc(c1)C(C)(C)C)C(C)(C)C)O4)=C(C=C(N3c1c(cccc1C(C)C)C(C)C)C)C |
Title of publication | Synthesis ofN-Aryloxy-β-diketiminate Ligands and Coordination to Zirconium, Ytterbium, Thorium, and Uranium |
Authors of publication | Dulong, Florian; Thuéry, Pierre; Ephritikhine, Michel; Cantat, Thibault |
Journal of publication | Organometallics |
Year of publication | 2013 |
Journal volume | 32 |
Journal issue | 5 |
Pages of publication | 1328 |
a | 21.2552 ± 0.001 Å |
b | 10.7158 ± 0.0005 Å |
c | 25.9523 ± 0.0007 Å |
α | 90° |
β | 102.364 ± 0.003° |
γ | 90° |
Cell volume | 5774 ± 0.4 Å3 |
Cell temperature | 150 ± 2 K |
Ambient diffraction temperature | 150 ± 2 K |
Number of distinct elements | 5 |
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 | 0.0335 |
Residual factor for significantly intense reflections | 0.0254 |
Weighted residual factors for significantly intense reflections | 0.0567 |
Weighted residual factors for all reflections included in the refinement | 0.0586 |
Goodness-of-fit parameter for all reflections included in the refinement | 0.989 |
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/4080265.html
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