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Information card for entry 2232849
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| Coordinates | 2232849.cif |
|---|---|
| Structure factors | 2232849.hkl |
| Original IUCr paper | HTML |
| Chemical name | [μ-Bis(diphenylphosphanyl-κ<i>P</i>)methane]decacarbonyltri-μ-hydrido- trirhenium(I)(3 <i>Re</i>—<i>Re</i>) dichloromethane solvate |
|---|---|
| Formula | C36 H27 Cl2 O10 P2 Re3 |
| Calculated formula | C36 H27 Cl2 O10 P2 Re3 |
| Title of publication | [μ-Bis(diphenylphosphanyl-κ<i>P</i>)methane]decacarbonyltri-μ-hydrido-trirhenium(I)(3 <i>Re</i>—<i>Re</i>) dichloromethane solvate |
| Authors of publication | Abdel-Magied, Ahmed F.; Singh, Amrendra K.; Haukka, Matti; Nordlander, Ebbe |
| Journal of publication | Acta Crystallographica Section E |
| Year of publication | 2011 |
| Journal volume | 67 |
| Journal issue | 12 |
| Pages of publication | m1816 |
| a | 16.7907 ± 0.0006 Å |
| b | 14.5316 ± 0.0005 Å |
| c | 17.1593 ± 0.0006 Å |
| α | 90° |
| β | 106.445 ± 0.001° |
| γ | 90° |
| Cell volume | 4015.5 ± 0.2 Å3 |
| Cell temperature | 100 ± 2 K |
| Ambient diffraction temperature | 100 ± 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 | 0.0413 |
| Residual factor for significantly intense reflections | 0.032 |
| Weighted residual factors for significantly intense reflections | 0.0765 |
| Weighted residual factors for all reflections included in the refinement | 0.0812 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.058 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | Yes |
| Has Fobs | Yes |
| Revision | Date | Message | Files |
|---|---|---|---|
| 181250 (current) | 2016-04-03 | hkl/2/23/ (antanas@echidna) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 2/23/28. |
2232849.cif 2232849.hkl |
| 176798 | 2016-02-21 | cif/2/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 2/23. |
2232849.cif 2232849.hkl |
| 120072 | 2014-07-11 | Adding DOIs to range 2 structures. | 2232849.cif 2232849.hkl |
| 88064 | 2013-08-29 | Adding _cod_database_fobs_code data item to all COD CIFs that have Fobs deposited and did not have this data item yet. | 2232849.cif 2232849.hkl |
| 31968 | 2012-01-03 | hkl/ Adding automatically assigned IUCr Fobs data for the rest of the year 2001 structures. |
2232849.cif 2232849.hkl |
| 31730 | 2012-01-02 | ../uploads/cif-deposit/cod/cif Adding structures of 2232849 via cif-deposit CGI script. |
2232849.cif |
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Users of the data should acknowledge the original authors of the
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