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Information card for entry 4335407
Preview
| Coordinates | 4335407.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C9 H20 P2 S3 |
|---|---|
| Calculated formula | C9 H20 P2 S3 |
| Title of publication | Chalcogenation of the 1,4-C2P4 Ring: Oxidation, Isomerization, Insertion, and Ring Contraction |
| Authors of publication | Philip J. W. Elder; Tristram Chivers |
| Journal of publication | Inorganic Chemistry |
| Year of publication | 2013 |
| Journal volume | 52 |
| Pages of publication | 7791 - 7804 |
| a | 9.382 ± 0.0004 Å |
| b | 7.878 ± 0.0008 Å |
| c | 19.202 ± 0.0015 Å |
| α | 90° |
| β | 90° |
| γ | 90° |
| Cell volume | 1419.25 ± 0.19 Å3 |
| Cell temperature | 173 ± 2 K |
| Ambient diffraction temperature | 173 ± 2 K |
| Number of distinct elements | 4 |
| Space group number | 64 |
| Hermann-Mauguin space group symbol | C m c a |
| Hall space group symbol | -C 2ac 2 |
| Residual factor for all reflections | 0.05 |
| Residual factor for significantly intense reflections | 0.0455 |
| Weighted residual factors for significantly intense reflections | 0.1312 |
| Weighted residual factors for all reflections included in the refinement | 0.1351 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.348 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 176432 (current) | 2016-02-14 | cif/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries. |
4335407.cif |
| 101335 | 2014-02-11 | cif/ Adding structures of 4335407 via cif-deposit CGI script. |
4335407.cif |
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Users of the data should acknowledge the original authors of the
structural data.