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Information card for entry 4037675
Preview
Coordinates | 4037675.cif |
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Original paper (by DOI) | HTML |
Formula | C60 H64 O14 S2 |
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Calculated formula | C60 H64 O14 S2 |
Title of publication | Construction of Sulfonyl Dihydrobenzo[<i>c</i>]xanthen-7-ones Core via NH<sub>4</sub>OAc/PdCl<sub>2</sub>/CuCl<sub>2</sub>-Mediated Double Cyclocondensation of α-Sulfonyl <i>o</i>-Hydroxyacetophenones with 2-Allylbenzaldehydes. |
Authors of publication | Hsueh, Nai-Chen; Tsai, Min-Chen; Chang, Meng-Yang; Chen, Hsing-Yin |
Journal of publication | The Journal of organic chemistry |
Year of publication | 2019 |
a | 12.6557 ± 0.0011 Å |
b | 14.4552 ± 0.0012 Å |
c | 16.5189 ± 0.0015 Å |
α | 82.644 ± 0.003° |
β | 87.9 ± 0.003° |
γ | 68.138 ± 0.002° |
Cell volume | 2781.4 ± 0.4 Å3 |
Cell temperature | 100 ± 2 K |
Ambient diffraction temperature | 100 ± 2 K |
Number of distinct elements | 4 |
Space group number | 2 |
Hermann-Mauguin space group symbol | P -1 |
Hall space group symbol | -P 1 |
Residual factor for all reflections | 0.0996 |
Residual factor for significantly intense reflections | 0.0677 |
Weighted residual factors for significantly intense reflections | 0.1712 |
Weighted residual factors for all reflections included in the refinement | 0.1882 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.069 |
Diffraction radiation wavelength | 0.71073 Å |
Diffraction radiation type | MoKα |
Has coordinates | Yes |
Has disorder | Yes |
Has Fobs | No |
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The link is: https://www.crystallography.net/4037675.html
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