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Information card for entry 1505637
Preview
Coordinates | 1505637.cif |
---|---|
Original paper (by DOI) | HTML |
Formula | C19 H32 O3 Si |
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Calculated formula | C19 H32 O3 Si |
SMILES | [Si]([C@@H]1[C@@H]([C@@H]2C(=O)[C@]1(C(=C2)CCCC)CCCC)C(=O)O)(C)(C)C.[Si]([C@H]1[C@H]([C@H]2C(=O)[C@@]1(C(=C2)CCCC)CCCC)C(=O)O)(C)(C)C |
Title of publication | Lewis Acid promoted tandem intermolecular Diels-Alder/intramolecular allylation reactions of silyl-substituted 1,3-butadienes leading to multisubstituted 7-norbornenones and related polycyclic compounds. |
Authors of publication | Li, Dongzhen; Liu, Guangzhen; Hu, Qiaoshu; Wang, Chao; Xi, Zhenfeng |
Journal of publication | Organic letters |
Year of publication | 2007 |
Journal volume | 9 |
Journal issue | 26 |
Pages of publication | 5433 - 5436 |
a | 6.5493 ± 0.0013 Å |
b | 11.954 ± 0.002 Å |
c | 14.124 ± 0.003 Å |
α | 102.24 ± 0.03° |
β | 93.57 ± 0.03° |
γ | 102.03 ± 0.03° |
Cell volume | 1050.3 ± 0.4 Å3 |
Cell temperature | 293 ± 2 K |
Ambient diffraction temperature | 293 ± 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 | 0.0984 |
Residual factor for significantly intense reflections | 0.0503 |
Weighted residual factors for significantly intense reflections | 0.1177 |
Weighted residual factors for all reflections included in the refinement | 0.126 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.108 |
Diffraction radiation wavelength | 0.71073 Å |
Diffraction radiation type | MoKα |
Has coordinates | Yes |
Has disorder | No |
Has Fobs | No |
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