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Information card for entry 7016592
Preview
Coordinates | 7016592.cif |
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Original paper (by DOI) | HTML |
Formula | C18 H14 Bi F9 O4 S2 |
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Calculated formula | C18 H14 Bi F9 O4 S2 |
SMILES | [Bi]12(c3ccccc3C[S]2Cc2ccccc12)[OH2].C(C(C(C(F)(F)F)(F)F)(F)F)(F)(F)S(=O)(=O)[O-] |
Title of publication | Effect of butterfly-shaped sulfur-bridged ligand and counter anions on the catalytic activity and diastereoselectivity of organobismuth complexes. |
Authors of publication | Qiu, Renhua; Yin, Shuangfeng; Song, Xingxing; Meng, Zhengong; Qiu, Yimiao; Tan, Nianyuan; Xu, Xinhua; Luo, Shenglian; Dai, Feng-Rong; Au, Chak-Tong; Wong, Wai-Yeung |
Journal of publication | Dalton transactions (Cambridge, England : 2003) |
Year of publication | 2011 |
Journal volume | 40 |
Journal issue | 37 |
Pages of publication | 9482 - 9489 |
a | 19.5855 ± 0.0016 Å |
b | 11.7682 ± 0.001 Å |
c | 9.9156 ± 0.0008 Å |
α | 90° |
β | 96.034 ± 0.001° |
γ | 90° |
Cell volume | 2272.7 ± 0.3 Å3 |
Cell temperature | 173 ± 2 K |
Ambient diffraction temperature | 173 ± 2 K |
Number of distinct elements | 6 |
Space group number | 14 |
Hermann-Mauguin space group symbol | P 1 21/c 1 |
Hall space group symbol | -P 2ybc |
Residual factor for all reflections | 0.038 |
Residual factor for significantly intense reflections | 0.0347 |
Weighted residual factors for significantly intense reflections | 0.096 |
Weighted residual factors for all reflections included in the refinement | 0.0986 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.039 |
Diffraction radiation wavelength | 0.71073 Å |
Diffraction radiation type | MoKα |
Has coordinates | Yes |
Has disorder | No |
Has Fobs | No |
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