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Information card for entry 1567195
Preview
Coordinates | 1567195.cif |
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Original paper (by DOI) | HTML |
Formula | C12 H6 N6 S Zn |
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Calculated formula | C12 H6 N6 S Zn |
Title of publication | Building an emission library of donor-acceptor-donor type linker-based luminescent metal-organic frameworks. |
Authors of publication | Xia, Hai-Lun; Zhou, Kang; Wu, Shenjie; Ren, Daming; Xing, Kai; Guo, Jiandong; Wang, Xiaotai; Liu, Xiao-Yuan; Li, Jing |
Journal of publication | Chemical science |
Year of publication | 2022 |
Journal volume | 13 |
Journal issue | 27 |
Pages of publication | 8036 - 8044 |
a | 16.549 ± 0.0014 Å |
b | 16.549 ± 0.0014 Å |
c | 12.4563 ± 0.0012 Å |
α | 90° |
β | 90° |
γ | 90° |
Cell volume | 3411.4 ± 0.5 Å3 |
Cell temperature | 190 K |
Ambient diffraction temperature | 190 K |
Number of distinct elements | 5 |
Space group number | 80 |
Hermann-Mauguin space group symbol | I 41 |
Hall space group symbol | I 4bw |
Residual factor for all reflections | 0.077 |
Residual factor for significantly intense reflections | 0.0718 |
Weighted residual factors for significantly intense reflections | 0.1839 |
Weighted residual factors for all reflections included in the refinement | 0.1932 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.093 |
Diffraction radiation wavelength | 1.34139 Å |
Diffraction radiation type | GaKα |
Has coordinates | Yes |
Has disorder | No |
Has Fobs | No |
Revision | Date | Message | Files |
---|---|---|---|
277100 (current) | 2022-08-06 | cif/ Updating files of 1567192, 1567193, 1567194, 1567195, 1567196, 1567197 Original log message: Adding full bibliography for 1567192--1567197.cif. |
1567195.cif |
276409 | 2022-06-30 | cif/ Adding structures of 1567192, 1567193, 1567194, 1567195, 1567196, 1567197 via cif-deposit CGI script. |
1567195.cif |
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Users of the data should acknowledge the original authors of the
structural data.