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Information card for entry 7157365
Preview
Coordinates | 7157365.cif |
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Original paper (by DOI) | HTML |
Formula | C68 H65 N3 O21 |
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Calculated formula | C68 H65 N3 O21 |
Title of publication | Mono-functionalized derivatives and revised configurational assignment of amide naphthotubes. |
Authors of publication | Yao, Huan; Wang, Xiaoping; Xie, Mo; Wang, Yu-Mei; Quan, Mao; Yang, Liu-Pan; Jiang, Wei |
Journal of publication | Organic & biomolecular chemistry |
Year of publication | 2020 |
Journal volume | 18 |
Journal issue | 10 |
Pages of publication | 1900 - 1909 |
a | 18.6966 ± 0.001 Å |
b | 19.0196 ± 0.001 Å |
c | 18.8502 ± 0.001 Å |
α | 90° |
β | 111.438 ± 0.003° |
γ | 90° |
Cell volume | 6239.4 ± 0.6 Å3 |
Cell temperature | 100.03 K |
Ambient diffraction temperature | 100.03 K |
Number of distinct elements | 4 |
Space group number | 14 |
Hermann-Mauguin space group symbol | P 1 21/n 1 |
Hall space group symbol | -P 2yn |
Residual factor for all reflections | 0.0869 |
Residual factor for significantly intense reflections | 0.0715 |
Weighted residual factors for significantly intense reflections | 0.189 |
Weighted residual factors for all reflections included in the refinement | 0.2028 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.034 |
Diffraction radiation wavelength | 1.54178 Å |
Diffraction radiation type | CuKα |
Has coordinates | Yes |
Has disorder | Yes |
Has Fobs | No |
Revision | Date | Message | Files |
---|---|---|---|
250356 (current) | 2020-04-05 | cif/ Updating files of 7157362, 7157363, 7157364, 7157365 Original log message: Adding full bibliography for 7157362--7157365.cif. |
7157365.cif |
248407 | 2020-02-23 | cif/ Adding structures of 7157362, 7157363, 7157364, 7157365 via cif-deposit CGI script. |
7157365.cif |
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Users of the data should acknowledge the original authors of the
structural data.