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Information card for entry 4084409
Preview
Coordinates | 4084409.cif |
---|---|
Original paper (by DOI) | HTML |
Formula | C17 H16 P2 S2 |
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Calculated formula | C17 H16 P2 S2 |
SMILES | [C@@H]12[C@@H](C=CC1)SP(c1ccccc1)[P@@]2(c1ccccc1)=S.[C@H]12[C@H](C=CC1)SP(c1ccccc1)[P@]2(c1ccccc1)=S |
Title of publication | Revisiting the Chemistry of Phosphinidene Sulfides |
Authors of publication | Wang, Lili; Ganguly, Rakesh; Mathey, François |
Journal of publication | Organometallics |
Year of publication | 2014 |
Journal volume | 33 |
Journal issue | 19 |
Pages of publication | 5614 |
a | 8.2807 ± 0.0011 Å |
b | 9.2592 ± 0.0012 Å |
c | 10.5079 ± 0.0012 Å |
α | 96.082 ± 0.006° |
β | 92.159 ± 0.007° |
γ | 98.496 ± 0.007° |
Cell volume | 791.18 ± 0.17 Å3 |
Cell temperature | 103 ± 2 K |
Ambient diffraction temperature | 103 ± 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 | 0.133 |
Residual factor for significantly intense reflections | 0.0599 |
Weighted residual factors for significantly intense reflections | 0.1233 |
Weighted residual factors for all reflections included in the refinement | 0.1612 |
Goodness-of-fit parameter for all reflections included in the refinement | 0.991 |
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/4084409.html
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