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Information card for entry 1554318
Preview
Coordinates | 1554318.cif |
---|---|
Original paper (by DOI) | HTML |
Formula | C26 H23 N O2 S |
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Calculated formula | C26 H23 N O2 S |
SMILES | S(=O)(=O)(N1c2ccccc2C(=C(C1)C=C1CC1)c1ccccc1)c1ccc(cc1)C |
Title of publication | Gold- and silver-catalyzed intramolecular annulation and rearrangement of aniline-linked 1,6-enynes containing methylenecyclopropanes |
Authors of publication | Jiang, Bo; Wei, Yin; Shi, Min |
Journal of publication | Organic Chemistry Frontiers |
Year of publication | 2018 |
Journal volume | 5 |
Journal issue | 13 |
Pages of publication | 2091 |
a | 9.447 ± 0.004 Å |
b | 10.559 ± 0.005 Å |
c | 12.512 ± 0.006 Å |
α | 76.431 ± 0.008° |
β | 77.755 ± 0.009° |
γ | 64.585 ± 0.007° |
Cell volume | 1087 ± 0.9 Å3 |
Cell temperature | 296 ± 2 K |
Ambient diffraction temperature | 296 K |
Number of distinct elements | 5 |
Space group number | 2 |
Hermann-Mauguin space group symbol | P -1 |
Hall space group symbol | -P 1 |
Residual factor for all reflections | 0.1889 |
Residual factor for significantly intense reflections | 0.0964 |
Weighted residual factors for significantly intense reflections | 0.2442 |
Weighted residual factors for all reflections included in the refinement | 0.3157 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.014 |
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/1554318.html
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