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Information card for entry 7131471
Preview
Coordinates | 7131471.cif |
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Original paper (by DOI) | HTML |
Formula | C24 H25 N2 O S |
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Calculated formula | C24 H25 N2 O S |
Title of publication | Fischer's base-triggered formal (3+2) cycloadditions with 3-isothiocyanato oxindoles as acceptor-donor synthons. |
Authors of publication | Liu, Xiong-Wei; Chen, Zi-Yue; Liu, Ren-Ming; Zhang, Wen-Hui; Pan, Bo-Wen; Zhou, Jian; Tian, You-Ping; Zhou, Ying; Liu, Xiong-Li |
Journal of publication | Chemical communications (Cambridge, England) |
Year of publication | 2023 |
Journal volume | 59 |
Journal issue | 31 |
Pages of publication | 4652 - 4655 |
a | 7.4539 ± 0.0005 Å |
b | 9.848 ± 0.0006 Å |
c | 14.022 ± 0.0009 Å |
α | 78.299 ± 0.005° |
β | 84.219 ± 0.005° |
γ | 85.023 ± 0.005° |
Cell volume | 1000.46 ± 0.11 Å3 |
Cell temperature | 150 ± 0.1 K |
Ambient diffraction temperature | 150 ± 0.1 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 | 0.0616 |
Residual factor for significantly intense reflections | 0.053 |
Weighted residual factors for significantly intense reflections | 0.1462 |
Weighted residual factors for all reflections included in the refinement | 0.1523 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.051 |
Diffraction radiation probe | x-ray |
Diffraction radiation wavelength | 1.54184 Å |
Diffraction radiation type | CuKα |
Has coordinates | Yes |
Has disorder | No |
Has Fobs | No |
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