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Information card for entry 1519143
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| Coordinates | 1519143.cif |
|---|
| Formula | C21 H24 I2 O S3 W |
|---|---|
| Calculated formula | C21 H24 I2 O S3 W |
| Title of publication | C21H24I2OS3W |
| Authors of publication | Baker, Paul K.; Coles, Simon J.; Hursthouse, Michael B. |
| Journal of publication | Crystal Structure Report Archive |
| Year of publication | 1994 |
| Pages of publication | 1199 |
| a | 8.4576 ± 0.0019 Å |
| b | 13.494 ± 0.012 Å |
| c | 22.03 ± 0.02 Å |
| α | 90° |
| β | 99.48 ± 0.08° |
| γ | 90° |
| Cell volume | 2480 ± 3 Å3 |
| Cell temperature | 120 ± 2 K |
| Ambient diffraction temperature | 120 ± 2 K |
| Number of distinct elements | 6 |
| Space group number | 14 |
| Hermann-Mauguin space group symbol | P 1 21/c 1 |
| Hall space group symbol | -P 2ybc |
| Residual factor for all reflections | 0.0599 |
| Residual factor for significantly intense reflections | 0.0347 |
| Weighted residual factors for significantly intense reflections | 0.0692 |
| Weighted residual factors for all reflections included in the refinement | 0.0731 |
| Goodness-of-fit parameter for all reflections included in the refinement | 0.776 |
| Diffraction radiation wavelength | 0.71069 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 176729 (current) | 2016-02-18 | cif/ (antanas@echidna.ibt.lt) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in range 1. |
1519143.cif |
| 135455 | 2015-04-30 | cif/ Adding structures of 1519143 via cif-deposit CGI script. |
1519143.cif |
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Users of the data should acknowledge the original authors of the
structural data.