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Information card for entry 7712265
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Coordinates | 7712265.cif |
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Original paper (by DOI) | HTML |
Chemical name | Complex of Cu(I) iodide with 2-methyl-6-(methylthio)pyridine |
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Formula | C7 H9 Cu2 I2 N S |
Calculated formula | C7 H9 Cu2 I2 N 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 | 7.2585 ± 0.0003 Å |
b | 8.4812 ± 0.0004 Å |
c | 10.1289 ± 0.0004 Å |
α | 78.063 ± 0.001° |
β | 79.381 ± 0.001° |
γ | 88.74 ± 0.001° |
Cell volume | 599.53 ± 0.04 Å3 |
Cell temperature | 125 ± 2 K |
Ambient diffraction temperature | 125 ± 2 K |
Number of distinct elements | 6 |
Space group number | 2 |
Hermann-Mauguin space group symbol | P -1 |
Hall space group symbol | -P 1 |
Residual factor for all reflections | 0.0288 |
Residual factor for significantly intense reflections | 0.0252 |
Weighted residual factors for significantly intense reflections | 0.0618 |
Weighted residual factors for all reflections included in the refinement | 0.0639 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.047 |
Diffraction radiation wavelength | 0.71073 Å |
Diffraction radiation type | MoKα |
Has coordinates | Yes |
Has disorder | No |
Has Fobs | No |
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