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Information card for entry 1573234
Preview
Coordinates | 1573234.cif |
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Original paper (by DOI) | HTML |
Formula | C23 H13 As S2 |
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Calculated formula | C23 H13 As S2 |
Title of publication | Dithienoarsinines: Stable and Planer π-Extended Arsabenzenes |
Authors of publication | Sumida, Akifumi; Saeki, Akinori; Matsuo, Kyohei; Naka, Kensuke; Imoto, Hiroaki |
Journal of publication | Chemical Science |
Year of publication | 2024 |
a | 16.1897 ± 0.0005 Å |
b | 7.1373 ± 0.0003 Å |
c | 31.4478 ± 0.0009 Å |
α | 90° |
β | 90.732 ± 0.003° |
γ | 90° |
Cell volume | 3633.5 ± 0.2 Å3 |
Cell temperature | 100 K |
Ambient diffraction temperature | 100 K |
Number of distinct elements | 4 |
Space group number | 15 |
Hermann-Mauguin space group symbol | I 1 2/a 1 |
Hall space group symbol | -I 2ya |
Residual factor for all reflections | 0.0359 |
Residual factor for significantly intense reflections | 0.0345 |
Weighted residual factors for significantly intense reflections | 0.0909 |
Weighted residual factors for all reflections included in the refinement | 0.0919 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.084 |
Diffraction radiation probe | x-ray |
Diffraction radiation wavelength | 0.71073 Å |
Diffraction radiation type | MoKα |
Has coordinates | Yes |
Has disorder | No |
Has Fobs | No |
Revision | Date | Message | Files |
---|---|---|---|
296021 (current) | 2024-11-21 | cif/ Adding structures of 1573224, 1573225, 1573226, 1573227, 1573228, 1573229, 1573230, 1573231, 1573232, 1573233, 1573234, 1573235 via cif-deposit CGI script. |
1573234.cif |
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Users of the data should acknowledge the original authors of the
structural data.