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Information card for entry 2019327
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Coordinates | 2019327.cif |
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Original paper (by DOI) | HTML |
Common name | uranyl bis-nicotinate |
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Chemical name | di-oxo-uranium(VI) bis-nicotinate |
Formula | C12 H12 N2 O8 U |
Calculated formula | C12 H12 N2 O8 U |
SMILES | C1(=[O][U]2(O1)([OH2])(=O)([O]=C(c1cccnc1)O2)([OH2])=O)c1cccnc1 |
Title of publication | Diaquadioxobis(pyridine-3-carboxylato)uranium(VI) |
Authors of publication | Alcock, N. W.; Errington, W.; Kemp, T. J.; Leceiejewicz, J. |
Journal of publication | Acta Crystallographica Section C Crystal Structure Communications |
Year of publication | 1996 |
Journal volume | 52 |
Journal issue | 3 |
Pages of publication | 615 |
a | 5.645 ± 0.004 Å |
b | 7.286 ± 0.005 Å |
c | 9.784 ± 0.007 Å |
α | 106.33 ± 0.06° |
β | 106.03 ± 0.06° |
γ | 99.63 ± 0.05° |
Cell volume | 357.8 ± 0.5 Å3 |
Cell temperature | 210 ± 2 K |
Ambient diffraction temperature | 210 ± 2 K |
Number of distinct elements | 5 |
Space group number | 2 |
Hermann-Mauguin space group symbol | P -1 |
Hall space group symbol | -P 1 |
Residual factor for all reflections | 0.0216 |
Residual factor for significantly intense reflections | 0.0197 |
Weighted residual factors for all reflections | 0.0572 |
Weighted residual factors for significantly intense reflections | 0.0508 |
Goodness-of-fit parameter for all reflections | 1.098 |
Goodness-of-fit parameter for significantly intense reflections | 1.098 |
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/2019327.html
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