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Information card for entry 7108354
Preview
Coordinates | 7108354.cif |
---|---|
Original paper (by DOI) | HTML |
Formula | C23 H18 F3 N O4 S2 |
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Calculated formula | C23 H18 F3 N O4 S2 |
SMILES | s1c([n+](cc1c1ccccc1)c1ccccc1)c1ccc(OC)cc1.S(=O)(=O)([O-])C(F)(F)F |
Title of publication | Abnormal oxazol-4-ylidene and thiazol-4-ylidene rhodium complexes: synthesis, structure, and properties |
Authors of publication | Jun Zhang; Jun Fu; Xiaolong Su; Xinke Qin; Meixin Zhao; Min Shi |
Journal of publication | Chem.Commun. |
Year of publication | 2012 |
Journal volume | 48 |
Pages of publication | 9625 |
a | 7.594 ± 0.006 Å |
b | 10.726 ± 0.009 Å |
c | 15.412 ± 0.012 Å |
α | 106.631 ± 0.009° |
β | 98.221 ± 0.01° |
γ | 103.331 ± 0.01° |
Cell volume | 1140.7 ± 1.6 Å3 |
Cell temperature | 293 ± 2 K |
Ambient diffraction temperature | 293 ± 2 K |
Number of distinct elements | 6 |
Space group number | 2 |
Hermann-Mauguin space group symbol | P -1 |
Hall space group symbol | -P 1 |
Residual factor for all reflections | 0.1077 |
Residual factor for significantly intense reflections | 0.0978 |
Weighted residual factors for significantly intense reflections | 0.2606 |
Weighted residual factors for all reflections included in the refinement | 0.274 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.161 |
Diffraction radiation wavelength | 0.71073 Å |
Diffraction radiation type | MoKα |
Has coordinates | Yes |
Has disorder | No |
Has Fobs | No |
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The link is: https://www.crystallography.net/7108354.html
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Users of the data should acknowledge the original authors of the
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