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Information card for entry 4106087
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Coordinates | 4106087.cif |
---|---|
Original paper (by DOI) | HTML |
Formula | C126 H85 Co S3 |
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Calculated formula | C126 H85 Co S3 |
Title of publication | Isolation of Planar Four-Membered Aromatic Systems by Using Confined Spaces of Cobalt Pentaaryl[60]fullerene Complexes |
Authors of publication | Masashi Maruyama; Jing-Dong Guo; Shigeru Nagase; Eiichi Nakamura; Yutaka Matsuo |
Journal of publication | Journal of the American Chemical Society |
Year of publication | 2011 |
Journal volume | 133 |
Pages of publication | 6890 - 6893 |
a | 16.3208 ± 0.0003 Å |
b | 16.8986 ± 0.0004 Å |
c | 17.3102 ± 0.0005 Å |
α | 81.841 ± 0.002° |
β | 69.7535 ± 0.0017° |
γ | 73.2243 ± 0.0015° |
Cell volume | 4283.83 ± 0.19 Å3 |
Cell temperature | 153 ± 2 K |
Ambient diffraction temperature | 153 ± 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 | 0.0801 |
Residual factor for significantly intense reflections | 0.0618 |
Weighted residual factors for significantly intense reflections | 0.173 |
Weighted residual factors for all reflections included in the refinement | 0.1815 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.184 |
Diffraction radiation wavelength | 1.54187 Å |
Diffraction radiation type | CuKα |
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/4106087.html
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Users of the data should acknowledge the original authors of the
structural data.