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Information card for entry 7042322
Preview
Coordinates | 7042322.cif |
---|---|
Original paper (by DOI) | HTML |
Formula | C49 H62 N2 U |
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Calculated formula | C49 H62 N2 U |
SMILES | [c]12([cH]3[c]4([cH]5[cH]1[U]16789%10%112345([c]2([cH]1[c]6([cH]7[cH]82)C(C)(C)C)C(C)(C)C)[CH](=[C]9=[C]%10=C(c1cc(cc[n]%111)N(C)C)c1ccccc1)c1ccccc1)C(C)(C)C)C(C)(C)C |
Title of publication | Preparation of a uranium metallacyclocumulene and its reactivity towards unsaturated organic molecules. |
Authors of publication | Zhang, Lei; Hou, Guohua; Zi, Guofu; Ding, Wanjian; Walter, Marc D. |
Journal of publication | Dalton transactions (Cambridge, England : 2003) |
Year of publication | 2017 |
Journal volume | 46 |
Journal issue | 11 |
Pages of publication | 3716 - 3728 |
a | 10.997 ± 0.015 Å |
b | 12.383 ± 0.017 Å |
c | 15.72 ± 0.02 Å |
α | 91.91 ± 0.02° |
β | 90.78 ± 0.02° |
γ | 97.89 ± 0.02° |
Cell volume | 2119 ± 5 Å3 |
Cell temperature | 100 ± 2 K |
Ambient diffraction temperature | 100 ± 2 K |
Number of distinct elements | 4 |
Space group number | 2 |
Hermann-Mauguin space group symbol | P -1 |
Hall space group symbol | -P 1 |
Residual factor for all reflections | 0.1155 |
Residual factor for significantly intense reflections | 0.0678 |
Weighted residual factors for significantly intense reflections | 0.1586 |
Weighted residual factors for all reflections included in the refinement | 0.1836 |
Goodness-of-fit parameter for all reflections included in the refinement | 0.95 |
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/7042322.html
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