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Information card for entry 1557515
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Jmol._Canvas2D (Jmol) "jmolApplet0"[x]
Coordinates | 1557515.cif |
---|---|
Original paper (by DOI) | HTML |
Formula | C102 H110 Li4 N6 O18 |
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Calculated formula | C102 H110 Li4 N6 O18 |
Title of publication | Nanoscale rotational dynamics of four independent rotators confined in crowded crystalline layers. |
Authors of publication | Rodríguez-Fortea, Antonio; Canadell, Enric; Wzietek, Pawel; Lemouchi, Cyprien; Allain, Magali; Zorina, Leokadiya; Batail, Patrick |
Journal of publication | Nanoscale |
Year of publication | 2020 |
Journal volume | 12 |
Journal issue | 15 |
Pages of publication | 8294 - 8302 |
a | 11.098 ± 0.002 Å |
b | 11.0981 ± 0.0009 Å |
c | 42.151 ± 0.008 Å |
α | 91.082 ± 0.009° |
β | 97.39 ± 0.01° |
γ | 115.846 ± 0.008° |
Cell volume | 4617.1 ± 1.3 Å3 |
Cell temperature | 120 ± 1 K |
Ambient diffraction temperature | 120 ± 1 K |
Number of distinct elements | 5 |
Space group number | 2 |
Hermann-Mauguin space group symbol | P -1 |
Hall space group symbol | -P 1 |
Residual factor for all reflections | 0.1252 |
Residual factor for significantly intense reflections | 0.0735 |
Weighted residual factors for significantly intense reflections | 0.1832 |
Weighted residual factors for all reflections included in the refinement | 0.2109 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.013 |
Diffraction radiation probe | x-ray |
Diffraction radiation wavelength | 0.71073 Å |
Diffraction radiation type | MoKα |
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/1557515.html
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Users of the data should acknowledge the original authors of the
structural data.