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Information card for entry 7114861
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Coordinates | 7114861.cif |
---|---|
Original paper (by DOI) | HTML |
Common name | none |
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Chemical name | trans-9,10-dihydroxy-9,10-di-p-tert-butylphenyl-9,10-dihydroanthracene. 3(N,N-dimethylformamide). 1(dimethyl sulfoxide) clathrate |
Formula | C45 H63 N3 O6 S |
Calculated formula | C45 H36 N3 O6 S |
Title of publication | Tunable clathrates |
Authors of publication | Caira, Mino R.; Roex, Tanya le; Nassimbeni, Luigi R. |
Journal of publication | Chemical Communications |
Year of publication | 2001 |
Journal issue | 20 |
Pages of publication | 2128 |
a | 9.0806 ± 0.0004 Å |
b | 9.0909 ± 0.0003 Å |
c | 14.6632 ± 0.0007 Å |
α | 72.294 ± 0.001° |
β | 87.66 ± 0.001° |
γ | 70.299 ± 0.002° |
Cell volume | 1083.05 ± 0.08 Å3 |
Cell temperature | 293 ± 2 K |
Ambient diffraction temperature | 293 ± 2 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 | 0.1984 |
Residual factor for significantly intense reflections | 0.141 |
Weighted residual factors for significantly intense reflections | 0.3819 |
Weighted residual factors for all reflections included in the refinement | 0.4025 |
Goodness-of-fit parameter for all reflections included in the refinement | 2.44 |
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/7114861.html
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