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Information card for entry 4335259
Preview
Coordinates | 4335259.cif |
---|---|
Original paper (by DOI) | HTML |
Formula | C9 H19 Bi Cl2 F3 N O3 P2 S |
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Calculated formula | C9 H19 Bi Cl2 F3 N O3 P2 S |
SMILES | [Bi]1([P](C)(C)CC[P]1(C)C)(Cl)Cl.S(=O)(=O)([O-])C(F)(F)F.CC#N |
Title of publication | Coordination Complexes of Bismuth Triflates with Tetrahydrofuran and Diphosphine Ligands |
Authors of publication | Chitnis, Saurabh S.; Burford, Neil; Decken, Andreas; Ferguson, Michael J. |
Journal of publication | Inorganic Chemistry |
Year of publication | 2013 |
Journal volume | 52 |
Journal issue | 12 |
Pages of publication | 7242 - 7248 |
a | 21.285 ± 0.0016 Å |
b | 15.2439 ± 0.0016 Å |
c | 12.3056 ± 0.001 Å |
α | 90° |
β | 95.629 ± 0.002° |
γ | 90° |
Cell volume | 3973.5 ± 0.6 Å3 |
Cell temperature | 198 ± 1 K |
Ambient diffraction temperature | 198 ± 1 K |
Number of distinct elements | 9 |
Space group number | 15 |
Hermann-Mauguin space group symbol | C 1 2/c 1 |
Hall space group symbol | -C 2yc |
Residual factor for all reflections | 0.0274 |
Residual factor for significantly intense reflections | 0.0229 |
Weighted residual factors for significantly intense reflections | 0.0557 |
Weighted residual factors for all reflections included in the refinement | 0.0583 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.037 |
Diffraction radiation probe | x-ray |
Diffraction radiation wavelength | 0.71073 Å |
Diffraction radiation type | MoKα |
Has coordinates | Yes |
Has disorder | No |
Has Fobs | No |
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