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Information card for entry 7156597
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Coordinates | 7156597.cif |
---|---|
Original paper (by DOI) | HTML |
Formula | C54 H46 Cl2 N4 O6 |
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Calculated formula | C54 H46 Cl2 N4 O6 |
Title of publication | Palladium-catalysed ring-opening [3 + 2]-annulation of spirovinylcyclopropyl oxindole to diastereoselectively access spirooxindoles. |
Authors of publication | Xiao, Jun-An; Cheng, Xiu-Liang; Li, Yu-Chun; He, Yi-Miao; Li, Jin-Lian; Liu, Zhi-Ping; Xia, Peng-Ju; Su, Wei; Yang, Hua |
Journal of publication | Organic & biomolecular chemistry |
Year of publication | 2018 |
Journal volume | 17 |
Journal issue | 1 |
Pages of publication | 103 - 107 |
a | 8.9496 ± 0.0003 Å |
b | 9.6224 ± 0.0003 Å |
c | 14.1054 ± 0.0005 Å |
α | 100.823 ± 0.0011° |
β | 90.1216 ± 0.0011° |
γ | 110.257 ± 0.001° |
Cell volume | 1116.34 ± 0.07 Å3 |
Cell temperature | 293 ± 2 K |
Ambient diffraction temperature | 293 ± 2 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 | 0.0578 |
Residual factor for significantly intense reflections | 0.0446 |
Weighted residual factors for significantly intense reflections | 0.1129 |
Weighted residual factors for all reflections included in the refinement | 0.121 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.025 |
Diffraction radiation wavelength | 0.71076 Å |
Diffraction radiation type | MoKα |
Has coordinates | Yes |
Has disorder | No |
Has Fobs | No |
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Users of the data should acknowledge the original authors of the
structural data.