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Information card for entry 1550368
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Coordinates | 1550368.cif |
---|---|
Original paper (by DOI) | HTML |
Common name | Eu@C2(13)-C80 Ni(OEP) |
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Chemical name | Eu@C2(13)-C80 Ni(OEP) |
Formula | C130.05 H53.66 Eu N4 Ni S0.78 |
Calculated formula | C130.05 H53.66 Eu1.0002 N4 Ni S0.78 |
Title of publication | Crystallographic identification of Eu@C2n (2n = 88, 86 and 84): completing a transformation map for existing metallofullerenes |
Authors of publication | Bao, Lipiao; Yu, Pengyuan; Pan, Changwang; Shen, Wangqiang; Lu, Xing |
Journal of publication | Chemical Science |
Year of publication | 2019 |
a | 25.3346 ± 0.0008 Å |
b | 15.1339 ± 0.0005 Å |
c | 19.9751 ± 0.0006 Å |
α | 90° |
β | 95.659 ± 0.001° |
γ | 90° |
Cell volume | 7621.4 ± 0.4 Å3 |
Cell temperature | 100 ± 2 K |
Ambient diffraction temperature | 100 ± 2 K |
Number of distinct elements | 6 |
Space group number | 12 |
Hermann-Mauguin space group symbol | C 1 2/m 1 |
Hall space group symbol | -C 2y |
Residual factor for all reflections | 0.0979 |
Residual factor for significantly intense reflections | 0.0905 |
Weighted residual factors for significantly intense reflections | 0.2303 |
Weighted residual factors for all reflections included in the refinement | 0.2371 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.046 |
Diffraction radiation wavelength | 0.6525 Å |
Diffraction radiation type | synchrotron |
Has coordinates | Yes |
Has disorder | Yes |
Has Fobs | No |
For the version history of this entry, please navigate to main COD server.
The link is: https://www.crystallography.net/1550368.html
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Users of the data should acknowledge the original authors of the
structural data.