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Information card for entry 2236232
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| Coordinates | 2236232.cif |
|---|---|
| Structure factors | 2236232.hkl |
| Original IUCr paper | HTML |
| Chemical name | (2-Aminoethanethiolato-κ^2^<i>N</i>,<i>S</i>)bis[1,2- bis(diphenylphosphanyl)ethane-κ^2^<i>P</i>,<i>P</i>']ruthenium(II) hexafluoridophosphate |
|---|---|
| Formula | C54 H54 F6 N P5 Ru S |
| Calculated formula | C54 H54 F6 N P5 Ru S |
| Title of publication | (2-Aminoethanethiolato-κ^2^<i>N</i>,<i>S</i>)bis[1,2-bis(diphenylphosphanyl)ethane-κ^2^<i>P</i>,<i>P</i>']ruthenium(II) hexafluoridophosphate |
| Authors of publication | Igashira-Kamiyama, Asako; Tamura, Motoshi; Konno, Takumi |
| Journal of publication | Acta Crystallographica Section E |
| Year of publication | 2012 |
| Journal volume | 68 |
| Journal issue | 11 |
| Pages of publication | m1432 |
| a | 21.1985 ± 0.0017 Å |
| b | 11.4 ± 0.0009 Å |
| c | 20.9346 ± 0.0017 Å |
| α | 90° |
| β | 106.588 ± 0.002° |
| γ | 90° |
| Cell volume | 4848.6 ± 0.7 Å3 |
| Cell temperature | 200 ± 2 K |
| Ambient diffraction temperature | 200 ± 2 K |
| Number of distinct elements | 7 |
| Space group number | 9 |
| Hermann-Mauguin space group symbol | C 1 c 1 |
| Hall space group symbol | C -2yc |
| Residual factor for all reflections | 0.0689 |
| Residual factor for significantly intense reflections | 0.0438 |
| Weighted residual factors for significantly intense reflections | 0.0918 |
| Weighted residual factors for all reflections included in the refinement | 0.1124 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.204 |
| Diffraction radiation wavelength | 0.71075 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | Yes |
| Has Fobs | Yes |
| Revision | Date | Message | Files |
|---|---|---|---|
| 181284 (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 2/23/62. |
2236232.cif 2236232.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. |
2236232.cif 2236232.hkl |
| 120072 | 2014-07-11 | Adding DOIs to range 2 structures. | 2236232.cif 2236232.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. | 2236232.cif 2236232.hkl |
| 74188 | 2013-02-22 | hkl/ Adding the rest of the Fobs data for the structures publishe din the IUCr journals in 2012 and in January of 2013. |
2236232.cif 2236232.hkl |
| 69801 | 2012-12-21 | cif/ Adding structures of 2236232 via cif-deposit CGI script. |
2236232.cif |
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Users of the data should acknowledge the original authors of the
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