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Information card for entry 4034122
Preview
Coordinates | 4034122.cif |
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Original paper (by DOI) | HTML |
Formula | C24 H19 N O2 |
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Calculated formula | C24 H19 N O2 |
SMILES | O=C1c2ccccc2C(NC(=O)C)C1=C(c1ccccc1)c1ccccc1 |
Title of publication | Brønsted-Acid-Catalyzed Synthesis of 3-Alkoxy and 3-Sulfamido Indanones via a Tandem Cyclization. |
Authors of publication | Zhou, Ni-Ni; Ning, Si-Si; Tong, Xiao-Juan; Luo, Ting-Ting; Yang, Jin; Li, Lin-Qiang; Fan, Ming-Jin; Yang, De-Suo; Zhu, Hai-Tao |
Journal of publication | The Journal of organic chemistry |
Year of publication | 2019 |
Journal volume | 84 |
Journal issue | 13 |
Pages of publication | 8497 - 8508 |
a | 13.1392 ± 0.0008 Å |
b | 9.4856 ± 0.0005 Å |
c | 15.3103 ± 0.0011 Å |
α | 90° |
β | 96.132 ± 0.007° |
γ | 90° |
Cell volume | 1897.3 ± 0.2 Å3 |
Cell temperature | 293.35 ± 0.1 K |
Ambient diffraction temperature | 293.35 ± 0.1 K |
Number of distinct elements | 4 |
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 | 0.1283 |
Residual factor for significantly intense reflections | 0.0747 |
Weighted residual factors for significantly intense reflections | 0.1588 |
Weighted residual factors for all reflections included in the refinement | 0.1969 |
Goodness-of-fit parameter for all reflections included in the refinement | 0.993 |
Diffraction radiation wavelength | 0.71073 Å |
Diffraction radiation type | MoKα |
Has coordinates | Yes |
Has disorder | No |
Has Fobs | No |
For the version history of this entry, please navigate to main COD server.
The link is: https://www.crystallography.net/4034122.html
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