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Information card for entry 7156742
Preview
Coordinates | 7156742.cif |
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Original paper (by DOI) | HTML |
Formula | C28 H25 Cl N4 O2 S |
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Calculated formula | C28 H25 Cl N4 O2 S |
Title of publication | A facile one pot synthesis of thiazolo[3,2-a]benzimidazole and pyran fused polyheterocyclic scaffolds. |
Authors of publication | Mariappan, Arumugam; Rajaguru, Kandasamy; Muthusubramanian, Shanmugam; Bhuvanesh, Nattamai |
Journal of publication | Organic & biomolecular chemistry |
Year of publication | 2019 |
Journal volume | 17 |
Journal issue | 17 |
Pages of publication | 4196 - 4199 |
a | 23.3244 ± 0.0007 Å |
b | 9.7484 ± 0.0003 Å |
c | 23.6714 ± 0.0007 Å |
α | 90° |
β | 107.472 ± 0.002° |
γ | 90° |
Cell volume | 5134 ± 0.3 Å3 |
Cell temperature | 99.99 K |
Ambient diffraction temperature | 99.99 K |
Number of distinct elements | 6 |
Space group number | 14 |
Hermann-Mauguin space group symbol | P 1 21/n 1 |
Hall space group symbol | -P 2yn |
Residual factor for all reflections | 0.0746 |
Residual factor for significantly intense reflections | 0.0549 |
Weighted residual factors for significantly intense reflections | 0.1081 |
Weighted residual factors for all reflections included in the refinement | 0.1168 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.055 |
Diffraction radiation wavelength | 1.54178 Å |
Diffraction radiation type | CuKα |
Has coordinates | Yes |
Has disorder | No |
Has Fobs | No |
Revision | Date | Message | Files |
---|---|---|---|
225134 (current) | 2019-11-08 | cif/ Updating files of 7156742 Original log message: Adding full bibliography for 7156742.cif. |
7156742.cif |
214334 | 2019-03-26 | cif/ Adding structures of 7156742 via cif-deposit CGI script. |
7156742.cif |
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