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Information card for entry 1519340
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| Coordinates | 1519340.cif |
|---|
| Formula | C34 H24 Fe2 O2 |
|---|---|
| Calculated formula | C34 H24 Fe2 O2 |
| Title of publication | C34H24Fe2O2 |
| Authors of publication | Butler, Ian. R.; Gelbrich, Thomas; Hursthouse, Michael B. |
| Journal of publication | Crystal Structure Report Archive |
| Year of publication | 2001 |
| Pages of publication | 830 |
| a | 9.9133 ± 0.0002 Å |
| b | 11.0918 ± 0.0004 Å |
| c | 11.8105 ± 0.0004 Å |
| α | 83.123 ± 0.001° |
| β | 66.048 ± 0.0012° |
| γ | 83.667 ± 0.0012° |
| Cell volume | 1175.54 ± 0.06 Å3 |
| Cell temperature | 150 ± 2 K |
| Ambient diffraction temperature | 150 ± 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 | 0.0615 |
| Residual factor for significantly intense reflections | 0.0494 |
| Weighted residual factors for significantly intense reflections | 0.1079 |
| Weighted residual factors for all reflections included in the refinement | 0.1121 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.002 |
| Diffraction radiation wavelength | 0.71073 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. |
1519340.cif |
| 135691 | 2015-05-07 | cif/ Adding structures of 1519340 via cif-deposit CGI script. |
1519340.cif |
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Users of the data should acknowledge the original authors of the
structural data.