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Information card for entry 7156946
Preview
Coordinates | 7156946.cif |
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Original paper (by DOI) | HTML |
Formula | C19 H16 N2 O3 S2 |
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Calculated formula | C19 H16 N2 O3 S2 |
Title of publication | Cu(i) catalysed annulation of isothiocyanates/isocyanates with 2-iodo-sulfonamides: synthesis of benzodithiazines, benzothiadiazinones, benzothiazinylidene-anilines and benzothiazolylidene-anilines. |
Authors of publication | Sandeep, K.; Siva Reddy, Alla; Kumara Swamy, K. C. |
Journal of publication | Organic & biomolecular chemistry |
Year of publication | 2019 |
Journal volume | 17 |
Journal issue | 28 |
Pages of publication | 6880 - 6894 |
a | 7.507 ± 0.004 Å |
b | 16.207 ± 0.01 Å |
c | 29.663 ± 0.019 Å |
α | 90° |
β | 90° |
γ | 90° |
Cell volume | 3609 ± 4 Å3 |
Cell temperature | 298 ± 2 K |
Ambient diffraction temperature | 298 ± 2 K |
Number of distinct elements | 5 |
Space group number | 61 |
Hermann-Mauguin space group symbol | P b c a |
Hall space group symbol | -P 2ac 2ab |
Residual factor for all reflections | 0.1239 |
Residual factor for significantly intense reflections | 0.0722 |
Weighted residual factors for significantly intense reflections | 0.1853 |
Weighted residual factors for all reflections included in the refinement | 0.227 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.051 |
Diffraction radiation wavelength | 0.71073 Å |
Diffraction radiation type | MoKα |
Has coordinates | Yes |
Has disorder | No |
Has Fobs | No |
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The link is: https://www.crystallography.net/7156946.html
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