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Information card for entry 2228012
Preview
| Coordinates | 2228012.cif |
|---|---|
| Structure factors | 2228012.hkl |
| Original IUCr paper | HTML |
| Chemical name | {Bis[2-(3,5-dimethylpyrazol-1-yl-κ<i>N</i>^2^)ethyl]amine- κ<i>N</i>}chloridopalladium(II) chloride 0.25-hydrate |
|---|---|
| Formula | C14 H23.5 Cl2 N5 O0.25 Pd |
| Calculated formula | C14 H23 Cl2 N5 O0.25 Pd |
| Title of publication | {Bis[2-(3,5-dimethylpyrazol-1-yl-κ<i>N</i>^2^)ethyl]amine-κ<i>N</i>}chloridopalladium(II) chloride 0.25-hydrate |
| Authors of publication | Guzei, Ilia A.; Spencer, Lara C.; Miti, Nangamso; Darkwa, James |
| Journal of publication | Acta Crystallographica Section E |
| Year of publication | 2010 |
| Journal volume | 66 |
| Journal issue | 10 |
| Pages of publication | m1243 |
| a | 10.5995 ± 0.0008 Å |
| b | 12.474 ± 0.0009 Å |
| c | 13.8168 ± 0.001 Å |
| α | 90° |
| β | 99.865 ± 0.001° |
| γ | 90° |
| Cell volume | 1799.8 ± 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/n 1 |
| Hall space group symbol | -P 2yn |
| Residual factor for all reflections | 0.0303 |
| Residual factor for significantly intense reflections | 0.023 |
| Weighted residual factors for significantly intense reflections | 0.0529 |
| Weighted residual factors for all reflections included in the refinement | 0.0566 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.012 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | Yes |
| Has Fobs | Yes |
| Revision | Date | Message | Files |
|---|---|---|---|
| 181201 (current) | 2016-04-03 | hkl/2/22/ (antanas@echidna) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 2/22/80. |
2228012.cif 2228012.hkl |
| 176435 | 2016-02-14 | cif/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries from ranges 1, 2. |
2228012.cif 2228012.hkl |
| 120072 | 2014-07-11 | Adding DOIs to range 2 structures. | 2228012.cif 2228012.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. | 2228012.cif 2228012.hkl |
| 26848 | 2011-09-28 | cif/2/, hkl/2/, html/ Reorganising CIFs of the range 2* into the "prefix-directory" tree. |
2228012.cif 2228012.hkl |
| 5269 | 2010-12-22 | hkl/ Adding Fobs data for the recent IUCr-published structres. |
2228012.cif 2228012.hkl |
| 5049 | 2010-12-18 | ../uploads/cif-deposit/cod/cif Adding structures of 2228012 via cif-deposit CGI script. |
2228012.cif |
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Users of the data should acknowledge the original authors of the
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