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Information card for entry 7234670
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Coordinates | 7234670.cif |
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Original paper (by DOI) | HTML |
Chemical name | (E)-3-(5-(bis(4-ethoxyphenyl)amino)thiophen-2-yl)-1- (pyridin-3-yl)prop-2-en-1-one |
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Formula | C28 H26 N2 O3 S |
Calculated formula | C28 H26 N2 O3 S |
Title of publication | Small molecules of chalcone derivatives with high two-photon absorption activities in the near-IR region |
Authors of publication | Jingyun Tan; Yujin Zhang; Meirong Zhang; Xiaohe Tian; Yiming Wang; Shengli Li; Chuankui Wang; Hongping Zhou; Jiaxiang Yang; Yupeng Tian; Jieying Wu |
Journal of publication | Journal of Materials Chemistry C |
Year of publication | 2016 |
Journal volume | 4 |
Pages of publication | 3256 - 3267 |
a | 9.185 ± 0.004 Å |
b | 11.757 ± 0.005 Å |
c | 12.715 ± 0.005 Å |
α | 100.884 ± 0.006° |
β | 101.591 ± 0.005° |
γ | 106.3 ± 0.005° |
Cell volume | 1246.3 ± 0.9 Å3 |
Cell temperature | 293 ± 2 K |
Ambient diffraction temperature | 293 ± 2 K |
Number of distinct elements | 5 |
Space group number | 2 |
Hermann-Mauguin space group symbol | P -1 |
Hall space group symbol | -P 1 |
Residual factor for all reflections | 0.134 |
Residual factor for significantly intense reflections | 0.053 |
Weighted residual factors for significantly intense reflections | 0.1083 |
Weighted residual factors for all reflections included in the refinement | 0.1381 |
Goodness-of-fit parameter for all reflections included in the refinement | 0.931 |
Diffraction radiation wavelength | 0.71073 Å |
Diffraction radiation type | MoKα |
Has coordinates | Yes |
Has disorder | Yes |
Has Fobs | No |
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