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Information card for entry 1569436
Preview
Coordinates | 1569436.cif |
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Original paper (by DOI) | HTML |
Formula | C38 H51 N O9 |
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Calculated formula | C38 H51 N O9 |
SMILES | O=C(O)c1c(cc(c(c2ccc(cc2)C(=O)O)c1)c1ccc(cc1)C(=O)O)C(=O)[O-].O.[N+](CCCC)(CCCC)(CCCC)CCCC |
Title of publication | Bioinspired HOF-based luminescent skin sensor with triple mechanochromism responses for the recognition and collection of human biophysical signals. |
Authors of publication | Xu, Xin; Yan, Bing |
Journal of publication | Materials horizons |
Year of publication | 2023 |
Journal volume | 10 |
Journal issue | 6 |
Pages of publication | 2062 - 2074 |
a | 9.7279 ± 0.0018 Å |
b | 12.109 ± 0.002 Å |
c | 16.102 ± 0.003 Å |
α | 87.019 ± 0.007° |
β | 89.242 ± 0.007° |
γ | 70.646 ± 0.006° |
Cell volume | 1787.1 ± 0.6 Å3 |
Cell temperature | 145 K |
Ambient diffraction temperature | 145 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 | 0.1451 |
Residual factor for significantly intense reflections | 0.0843 |
Weighted residual factors for significantly intense reflections | 0.1861 |
Weighted residual factors for all reflections included in the refinement | 0.2186 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.041 |
Diffraction radiation wavelength | 0.71073 Å |
Diffraction radiation type | MoKα |
Has coordinates | Yes |
Has disorder | No |
Has Fobs | No |
Revision | Date | Message | Files |
---|---|---|---|
284824 (current) | 2023-07-05 | cif/ Adding structures of 1569436 via cif-deposit CGI script. |
1569436.cif |
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