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Information card for entry 7044357
Preview
Coordinates | 7044357.cif |
---|---|
Original paper (by DOI) | HTML |
Formula | C46 H56 N4 O2 U |
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Calculated formula | C46 H56 N4 O2 U |
SMILES | [U]123(Oc4c(cccc4C(C)C)C(C)C)(Oc4c(cccc4C(C)C)C(C)C)[N]4=C(C)C=C(N2c2c([N]3=C(C=C(N1c1ccccc41)C)C)cccc2)C |
Title of publication | New supporting ligands in actinide chemistry: tetramethyltetraazaannulene complexes with thorium and uranium |
Authors of publication | Hohloch, Stephan; Garner, Mary E.; Parker, Bernard F.; Arnold, John |
Journal of publication | Dalton Trans. |
Year of publication | 2017 |
a | 11.2024 ± 0.0008 Å |
b | 17.7114 ± 0.0012 Å |
c | 20.8161 ± 0.0015 Å |
α | 90° |
β | 102.734 ± 0.002° |
γ | 90° |
Cell volume | 4028.5 ± 0.5 Å3 |
Cell temperature | 100 ± 2 K |
Ambient diffraction temperature | 100 ± 2 K |
Number of distinct elements | 5 |
Space group number | 14 |
Hermann-Mauguin space group symbol | P 1 21/c 1 |
Hall space group symbol | -P 2ybc |
Residual factor for all reflections | 0.0628 |
Residual factor for significantly intense reflections | 0.0405 |
Weighted residual factors for significantly intense reflections | 0.087 |
Weighted residual factors for all reflections included in the refinement | 0.0964 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.054 |
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/7044357.html
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