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Information card for entry 4350609
Preview
Coordinates | 4350609.cif |
---|---|
Original paper (by DOI) | HTML |
Formula | C34 H46 F3 O9 P |
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Calculated formula | C34 H45 F3 O9 P |
SMILES | P12(O[C@@H]([C@H]3O[C@@H]4OC(O[C@@H]4[C@H]3O)(C)C)CO1)(Oc1c(cc(cc1Cc1cc(cc(c1O2)C(C)(C)C)C)C)C(C)(C)C)OCC(F)(F)F |
Title of publication | Biologically relevant phosphoranes: synthesis and structural characterization of glucofuranose-derived phosphoranes with penta- and hexacoordination at phosphorus. |
Authors of publication | Timosheva, Natalya V.; Chandrasekaran, A.; Holmes, Robert R. |
Journal of publication | Inorganic chemistry |
Year of publication | 2006 |
Journal volume | 45 |
Journal issue | 26 |
Pages of publication | 10836 - 10848 |
a | 10.8623 ± 0.0002 Å |
b | 25.046 ± 0.0004 Å |
c | 13.9799 ± 0.0003 Å |
α | 90° |
β | 109.215 ± 0.0007° |
γ | 90° |
Cell volume | 3591.46 ± 0.12 Å3 |
Cell temperature | 293 ± 2 K |
Ambient diffraction temperature | 293 ± 2 K |
Number of distinct elements | 5 |
Space group number | 4 |
Hermann-Mauguin space group symbol | P 1 21 1 |
Hall space group symbol | P 2yb |
Residual factor for all reflections | 0.0649 |
Residual factor for significantly intense reflections | 0.0527 |
Weighted residual factors for significantly intense reflections | 0.1282 |
Weighted residual factors for all reflections included in the refinement | 0.1375 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.03 |
Diffraction radiation wavelength | 0.71073 Å |
Diffraction radiation type | MoKα |
Has coordinates | Yes |
Has disorder | No |
Has Fobs | No |
For the version history of this entry, please navigate to main COD server.
The link is: https://www.crystallography.net/4350609.html
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Users of the data should acknowledge the original authors of the
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