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Information card for entry 7002736
Preview
Coordinates | 7002736.cif |
---|---|
Original paper (by DOI) | HTML |
Formula | C10 H6 N12 O22 U4 |
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Calculated formula | C10 H6 N12 O22 U4 |
SMILES | c1(c2ncccn2)n2[n](nn1)[U]13(=O)(O[U]4(=O)(n5c(c6ncccn6)nn[n]5[U]5(O[U]2([O]35)(=O)(=O)=O)([O]14)(=O)(=O)=O)(=O)=O)(=O)=O.O.O.O.O.O.O |
Title of publication | Influence of metal ions, coligands and reaction conditions on the structural versatility and properties of 5-pyrimidyl-tetrazolate containing complexes |
Authors of publication | Rodríguez-Diéguez, Antonio; Mota, Antonio J.; Seco, José M.; Palacios, María A.; Romerosa, Antonio; Colacio, Enrique |
Journal of publication | Dalton Transactions |
Year of publication | 2009 |
Journal issue | 43 |
Pages of publication | 9578 - 9586 |
a | 7.286 ± 0.0008 Å |
b | 9.1012 ± 0.001 Å |
c | 13.1812 ± 0.0014 Å |
α | 82.668 ± 0.001° |
β | 79.381 ± 0.002° |
γ | 73.624 ± 0.001° |
Cell volume | 821.59 ± 0.15 Å3 |
Cell temperature | 293 ± 2 K |
Ambient diffraction temperature | 293 ± 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 | 0.0398 |
Residual factor for significantly intense reflections | 0.029 |
Weighted residual factors for significantly intense reflections | 0.0595 |
Weighted residual factors for all reflections included in the refinement | 0.0649 |
Goodness-of-fit parameter for all reflections included in the refinement | 0.797 |
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/7002736.html
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Users of the data should acknowledge the original authors of the
structural data.