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Information card for entry 1519149
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| Coordinates | 1519149.cif |
|---|
| Formula | C45.5 H46 Cl2 Fe2 O3 P2 Pd |
|---|---|
| Calculated formula | C45.5 H46 Cl2 Fe2 O3 P2 Pd |
| Title of publication | C45.5H46Cl2Fe2O3P2Pd |
| Authors of publication | Butler, Ian R.; Coles, Simon J.; Hursthouse, Michael B. |
| Journal of publication | Crystal Structure Report Archive |
| Year of publication | 1994 |
| Pages of publication | 1194 |
| a | 9.697 ± 0.003 Å |
| b | 10.0628 ± 0.0013 Å |
| c | 13.213 ± 0.002 Å |
| α | 105.157 ± 0.014° |
| β | 97.17 ± 0.02° |
| γ | 112.543 ± 0.009° |
| Cell volume | 1112.1 ± 0.4 Å3 |
| Cell temperature | 120 ± 2 K |
| Ambient diffraction temperature | 120 ± 2 K |
| Number of distinct elements | 7 |
| Space group number | 2 |
| Hermann-Mauguin space group symbol | P -1 |
| Hall space group symbol | -P 1 |
| Residual factor for all reflections | 0.053 |
| Residual factor for significantly intense reflections | 0.0514 |
| Weighted residual factors for significantly intense reflections | 0.156 |
| Weighted residual factors for all reflections included in the refinement | 0.1579 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.091 |
| Diffraction radiation wavelength | 0.71069 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | Yes |
| 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. |
1519149.cif |
| 135461 | 2015-04-30 | cif/ Adding structures of 1519149 via cif-deposit CGI script. |
1519149.cif |
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Users of the data should acknowledge the original authors of the
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