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Information card for entry 2238496
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| Coordinates | 2238496.cif |
|---|---|
| Structure factors | 2238496.hkl |
| Original IUCr paper | HTML |
| Chemical name | Bis[<i>O</i>,<i>O</i>'-bis(4-<i>tert</i>-butylphenyl) dithiophosphato-κ^2^<i>S</i>,<i>S</i>']bis(pyridine-κ<i>N</i>)lead(II) |
|---|---|
| Formula | C50 H62 N2 O4 P2 Pb S4 |
| Calculated formula | C50 H62 N2 O4 P2 Pb S4 |
| Title of publication | Bis[<i>O</i>,<i>O</i>'-bis(4-<i>tert</i>-butylphenyl) dithiophosphato-κ^2^<i>S</i>,<i>S</i>']bis(pyridine-κ<i>N</i>)lead(II) |
| Authors of publication | Zhang, Xiulan; Xie, Bin; He, Linxin; Lu, Lu; Chen, Neng |
| Journal of publication | Acta Crystallographica Section E |
| Year of publication | 2013 |
| Journal volume | 69 |
| Journal issue | 9 |
| Pages of publication | m524 |
| a | 12.426 ± 0.0003 Å |
| b | 12.9136 ± 0.0003 Å |
| c | 17.9749 ± 0.0004 Å |
| α | 89.7528 ± 0.0018° |
| β | 79.4467 ± 0.0019° |
| γ | 71.298 ± 0.002° |
| Cell volume | 2681.23 ± 0.11 Å3 |
| Cell temperature | 150 ± 2 K |
| Ambient diffraction temperature | 150 ± 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 | 0.0462 |
| Residual factor for significantly intense reflections | 0.0328 |
| Weighted residual factors for significantly intense reflections | 0.0619 |
| Weighted residual factors for all reflections included in the refinement | 0.0675 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.016 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | Yes |
| Has Fobs | Yes |
| Revision | Date | Message | Files |
|---|---|---|---|
| 181306 (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 2/23/84. |
2238496.cif 2238496.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. |
2238496.cif 2238496.hkl |
| 89416 | 2013-10-25 | cif/ (saulius@koala.ibt.lt) Adding links pointing to FOBS data to the recently deposited structures from IUCr. |
2238496.cif 2238496.hkl |
| 89414 | 2013-10-24 | cod/ (saulius@koala.ibt.lt) Adding FOBS data for the recently deposited IUCr structures. |
2238496.cif 2238496.hkl |
| 88632 | 2013-10-02 | cif/ Adding structures of 2238496 via cif-deposit CGI script. |
2238496.cif |
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