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Information card for entry 7712259
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Coordinates | 7712259.cif |
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Original paper (by DOI) | HTML |
Chemical name | complex of copper(I) iodide with 3-ethoxy-2-methylthiopyridine |
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Formula | C8 H11 Cu2 I2 N O S |
Calculated formula | C8 H11 Cu2 I2 N O S |
Title of publication | A family of CuI-based 1D polymers showing colorful short-lived TADF and phosphorescence induced by photo- and X-ray irradiation |
Authors of publication | Artem'ev, Alexander; Doronina, Evgeniya Pavlovna; Rakhmanova, Marianna I.; Hei, Xiuze; Stass, Dmitri V.; Tarasova, Olga; Bagryanskaya, Irina Yu.; Samsonenko, Denis G.; Novikov, Alexander S.; Nedolya, Nina; Li, Jing |
Journal of publication | Dalton Transactions |
Year of publication | 2023 |
a | 4.3651 ± 0.0002 Å |
b | 19.7496 ± 0.0011 Å |
c | 15.8828 ± 0.0009 Å |
α | 90° |
β | 95.378 ± 0.003° |
γ | 90° |
Cell volume | 1363.21 ± 0.13 Å3 |
Cell temperature | 296 ± 2 K |
Ambient diffraction temperature | 296 ± 2 K |
Number of distinct elements | 7 |
Space group number | 14 |
Hermann-Mauguin space group symbol | P 1 21/c 1 |
Hall space group symbol | -P 2ybc |
Residual factor for all reflections | 0.0597 |
Residual factor for significantly intense reflections | 0.0572 |
Weighted residual factors for significantly intense reflections | 0.1352 |
Weighted residual factors for all reflections included in the refinement | 0.1367 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.021 |
Diffraction radiation wavelength | 0.71073 Å |
Diffraction radiation type | MoKα |
Has coordinates | Yes |
Has disorder | No |
Has Fobs | No |
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