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Information card for entry 7230947
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Coordinates | 7230947.cif |
---|---|
Original paper (by DOI) | HTML |
Formula | C21 H15 N3 S |
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Calculated formula | C21 H15 N3 S |
Title of publication | CuI nanoparticle-catalyzed synthesis of tetracyclic benzo[e]benzo[4,5]imidazo[1,2-c][1,3]thiazin-6-imine heterocycles by SNAr-type C‒S, C‒N bond formation from isothiocyanatobenzenes and benzimidazoles |
Authors of publication | Guo, Xiaolong; Wang, Luyao; Hu, Jing; Zhang, Mengmeng |
Journal of publication | RSC Advances |
Year of publication | 2018 |
Journal volume | 8 |
Journal issue | 39 |
Pages of publication | 22259 |
a | 23.3793 ± 0.0003 Å |
b | 7.2329 ± 0.0001 Å |
c | 19.5343 ± 0.0003 Å |
α | 90° |
β | 92.653 ± 0.001° |
γ | 90° |
Cell volume | 3299.71 ± 0.08 Å3 |
Cell temperature | 298.87 ± 0.12 K |
Ambient diffraction temperature | 298.87 ± 0.12 K |
Number of distinct elements | 4 |
Space group number | 15 |
Hermann-Mauguin space group symbol | C 1 2/c 1 |
Hall space group symbol | -C 2yc |
Residual factor for all reflections | 0.05 |
Residual factor for significantly intense reflections | 0.0471 |
Weighted residual factors for significantly intense reflections | 0.1295 |
Weighted residual factors for all reflections included in the refinement | 0.1321 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.094 |
Diffraction radiation probe | x-ray |
Diffraction radiation wavelength | 1.54184 Å |
Diffraction radiation type | CuKα |
Has coordinates | Yes |
Has disorder | No |
Has Fobs | No |
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