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Information card for entry 1551965
Preview
Coordinates | 1551965.cif |
---|---|
Original paper (by DOI) | HTML |
Formula | C40.4 H82.5 As K2 N4 Si3 U |
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Calculated formula | C37.5 H79.5 As K2 N4 Si3 U |
SMILES | [U]123([As])N([Si](C(C)C)(C(C)C)C(C)C)CC[N]3(CCN1[Si](C(C)C)(C(C)C)C(C)C)CCN2[Si](C(C)C)(C(C)C)C(C)C.[K+].[K+].c1ccccc1 |
Title of publication | Triamidoamine uranium(IV)-arsenic complexes containing one-, two- and threefold U-As bonding interactions |
Authors of publication | Benedict M. Gardner; Gabor Balazs; Manfred Scheer; Floriana Tuna; Eric J. L. McInnes; Jonathan McMaster; William Lewis; Alexander J. Blake; Stephen T. Liddle |
Journal of publication | Nature Chemistry |
Year of publication | 2015 |
Journal volume | 7 |
Pages of publication | 582 - 590 |
a | 17.84985 ± 0.00019 Å |
b | 34.2192 ± 0.0003 Å |
c | 32.8697 ± 0.0003 Å |
α | 90° |
β | 97.2734 ± 0.0009° |
γ | 90° |
Cell volume | 19915.5 ± 0.3 Å3 |
Cell temperature | 120 ± 2 K |
Ambient diffraction temperature | 120 ± 2 K |
Number of distinct elements | 7 |
Space group number | 14 |
Hermann-Mauguin space group symbol | P 1 21/n 1 |
Hall space group symbol | -P 2yn |
Residual factor for all reflections | 0.1293 |
Residual factor for significantly intense reflections | 0.1266 |
Weighted residual factors for significantly intense reflections | 0.3242 |
Weighted residual factors for all reflections included in the refinement | 0.3264 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.043 |
Diffraction radiation probe | x-ray |
Diffraction radiation wavelength | 1.54184 Å |
Diffraction radiation type | CuKa |
Has coordinates | Yes |
Has disorder | Yes |
Has Fobs | No |
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