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Information card for entry 6000115
Preview
| Coordinates | 6000115.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Chemical name | beta-trans-diammine dibromide palladium(II) |
|---|---|
| Formula | Br2 H6 N2 Pd |
| Calculated formula | Br2 N2 Pd |
| Title of publication | Structures of [Pd(NH~3~)~2~<i>X</i>~2~] and its chemical transformation in the solid state |
| Authors of publication | Kirik, S. D.; Solovyov, L. A.; Blokhin, A. I.; Yakimov, I. S. |
| Journal of publication | Acta Crystallographica, Section B: Structural Science |
| Year of publication | 2000 |
| Journal volume | 56 |
| Journal issue | 3 |
| Pages of publication | 419 - 425 |
| a | 8.4315 ± 0.0003 Å |
| b | 8.4206 ± 0.0003 Å |
| c | 8.0916 ± 0.0002 Å |
| α | 90° |
| β | 90° |
| γ | 90° |
| Cell volume | 574.49 ± 0.04 Å3 |
| Cell temperature | 293 K |
| Ambient diffraction temperature | 293 K |
| Number of distinct elements | 4 |
| Space group number | 61 |
| Hermann-Mauguin space group symbol | P b c a |
| Hall space group symbol | -P 2ac 2ab |
| Goodness-of-fit parameter for all reflections | 1.89 |
| Diffraction radiation wavelength | 1.5418 Å |
| Diffraction radiation type | CuKα |
| Duplicate of | 2102059 |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 277869 (current) | 2022-09-15 | cif/ Added space group information derived from the space group operation list using the 'cif_filter' program. |
6000115.cif |
| 209628 | 2018-08-12 | cif/ Updating bibliography in entries 2102057-2102061, 6000113-6000117. Marking entries 6000113-6000117 as duplicates of entries 2102057-2102061. |
6000115.cif |
| 176292 | 2016-02-09 | cif/6/ (antanas@kurmis) Removing the _[local]_cod_text data item from multiple entries in range 6, since it held the same information as other data items in the entries (bibliography data items, for example). Also, bibliography was updated in several entries. |
6000115.cif |
| 176230 | 2016-02-05 | cif/6/00/01/ Adding coordinates and other data from the supplementary material (http://dx.doi.org/10.1107/S0108768100000252/av0024sup1.cif) to entries 600011[34567]. |
6000115.cif |
| 130149 | 2015-01-27 | cod/ (saulius@kolibris) Deriving Hall space group symbols for 12003 CIFs using the 'cif_filter --estimate-spacegroup' command. |
6000115.cif |
| 35911 | 2012-02-28 | cif/ Reorganising ranges 1, 3, 5, 6 and 8 into a prefix-directory tree. |
6000115.cif |
| 966 | 2010-01-30 | cif/ Adding _cod_database_code tags to all COD entries. Adding tag description to the cif_cod.dic dictionary so that COD entries can be validated. |
6000115.cif |
| 878 | 2009-11-19 | cif/6/ Splitting the corrected 6.cif file, adding the splitted range 6 files: cif_split_primitive -o 6/ < 6.cif |
6000115.cif |
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Users of the data should acknowledge the original authors of the
structural data.