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Information card for entry 4086935
Preview
Coordinates | 4086935.cif |
---|---|
Original paper (by DOI) | HTML |
Formula | C38 H51 N3 S U |
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Calculated formula | C38 H51 N3 S U |
SMILES | C1C[NH]2CCN(c3c(C)cc(C)cc3C)[U]34562([c]2([c]3([c]4([c]5([c]62C)C)C)C)C)(N1c1c(C)cc(C)cc1C)Sc1ccccc1 |
Title of publication | A Uranium(IV) Triamide Species with Brønsted Basic Ligand Character: Metal‒Ligand Cooperativity in the f Block |
Authors of publication | Kiernicki, John J.; Staun, Selena L.; Zeller, Matthias; Bart, Suzanne C. |
Journal of publication | Organometallics |
Year of publication | 2017 |
Journal volume | 36 |
Journal issue | 3 |
Pages of publication | 665 |
a | 9.3331 ± 0.0002 Å |
b | 16.9164 ± 0.0003 Å |
c | 22.2563 ± 0.0003 Å |
α | 90° |
β | 90° |
γ | 90° |
Cell volume | 3513.88 ± 0.11 Å3 |
Cell temperature | 100 ± 2 K |
Ambient diffraction temperature | 100 ± 2 K |
Number of distinct elements | 5 |
Space group number | 19 |
Hermann-Mauguin space group symbol | P 21 21 21 |
Hall space group symbol | P 2ac 2ab |
Residual factor for all reflections | 0.0258 |
Residual factor for significantly intense reflections | 0.0258 |
Weighted residual factors for significantly intense reflections | 0.0639 |
Weighted residual factors for all reflections included in the refinement | 0.064 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.043 |
Diffraction radiation wavelength | 1.54178 Å |
Diffraction radiation type | CuKα |
Has coordinates | Yes |
Has disorder | No |
Has Fobs | No |
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